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17215925 ChemSpider 1.0 937 ChemSpider P13667 UniProt CHEBI:28919 ChEBI Catechol O-methyltransferase 1.0 439153 PubChem-compound 2-Hydroxyestrone SMILES O 1.0 ReactionCatalysis64393 ACTIVATION HMDB0001185 HMDB Stromal cell-derived factor 2-like protein 1 2616-64-0 CAS Cytochrome P450 3A5 NADPH Cytochrome P450 1A1 1.0 CHEBI:17474 ChEBI Uridine diphosphate glucuronic acid P21964 UniProt 1.0 SMILES [H][C@@]12C[C@@H](O)[C@H](O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 CHEBI:15846 ChEBI 1.0 C10H15N5O10P2 Adenosine 3',5'-diphosphate 427.02942 5870 PubChem-compound C15H23N6O5S S-Adenosylmethionine 399.14505 53-59-8 CAS C19H24O3 2-Methoxyestrone 300.17255 1.0 5756 PubChem-compound 5757 PubChem-compound NADH ESTRONE-SULFATE BioCyc 1038 PubChem-compound CHEBI:17200 ChEBI 1.0 Hydrogen Ion Endoplasmic reticulum resident protein 29 CHEBI:16474 ChEBI 952 ChemSpider GO:0005829 GENE ONTOLOGY C18H22O5S Estrone sulfate 350.1188 CHEBI:1189 ChEBI P11021 UniProt 566-76-7 CAS 1.0 CHEBI:16908 ChEBI C00468 KEGG Compound ADENOSYL-HOMO-CYS BioCyc UDP-GLUCURONATE BioCyc 6031 PubChem-compound Q6IN67 UniProt 485-80-3 CAS 1010 ChemSpider Estriol SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)N1C=CC(=O)NC1=O C21H30N7O17P3 NADPH 745.0911 3-5-ADP BioCyc HMDB0004483 HMDB HMDB0004482 HMDB C21H29N7O17P3 NADP 744.08325 Q9HCN8 UniProt Adenosine 3',5'-diphosphate C15H22N2O18P2 Uridine diphosphate glucuronic acid 580.0343 NADPH BioCyc 1053-73-2 CAS 1.0 C02538 KEGG Compound SMILES C[S+](CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N 979-92-0 CAS 1.0 Estradiol 17-beta-dehydrogenase 1 CHEBI:17263 ChEBI 2-Hydroxyestrone Cytosol CPD-6641 BioCyc SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C(OC)=C3 440624 PubChem-compound 3001028 PubChem-compound 440623 PubChem-compound 1.0 1.0 C14H20N6O5S S-Adenosylhomocysteine 384.12158 Cytochrome P450 3A5 58-68-4 CAS UDP-glucuronosyltransferase 1-1 HMDB0001425 HMDB HMDB0000335 HMDB HMDB0000217 HMDB SMILES C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OS(O)(=O)=O)=C4)[C@@H]1CCC2=O 1.0 Q96GW1 UniProt 1.0 NADH C00007 KEGG Compound Oxygen C00006 KEGG Compound CHEBI:15414 ChEBI Hydrogen Ion CHEBI:18009 ChEBI Q13087 UniProt 50-28-2 CAS C00001 KEGG Compound Q9UBS4 UniProt 9799 ChemSpider Estrone glucuronide 1.0 C00005 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound NADPH HMDB0000343 HMDB SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O Protein disulfide-isomerase A6 C24H32O8 2-Methoxyestrone 3-glucuronide 448.20972 HMDB0000221 HMDB C24H30O8 Estrone glucuronide 446.19406 SMILES NC(=O)C1=CN(C=CC1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H]2O[C@@H]([C@@H](OP(O)(O)=O)[C@H]2O)N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1O 159296 PubChem-compound 17473 PubChem-compound C05141 KEGG Compound C11133 KEGG Compound C11132 KEGG Compound Estradiol ReactionCatalysis64445 ACTIVATION 53-57-6 CAS C00019 KEGG Compound DnaJ homolog subfamily B member 11 Protein disulfide-isomerase A4 HSP90B1 protein 1.0 ReactionCatalysis64449 ACTIVATION C21H28N7O14P2 NAD 664.11694 S-ADENOSYLMETHIONINE BioCyc 1.0 78 kDa glucose-regulated protein HMDB0000902 HMDB C00015 KEGG Compound 5660 ChemSpider CHEBI:27974 ChEBI C21H29N7O14P2 NADH 665.12476 NAD(P) BioCyc Estrogen sulfotransferase 1.0 1.0 389514 ChemSpider H Hydrogen Ion 1.007825 50-27-1 CAS 388301 ChemSpider UDP-glucuronosyltransferase 1-1 ReactionCatalysis64433 ACTIVATION Stromal cell-derived factor 2-like protein 1 389515 ChemSpider Endoplasmic reticulum resident protein 29 Protein disulfide-isomerase A4 1.0 Protein disulfide-isomerase A6 Peptidyl-prolyl cis-trans isomerase B C00021 KEGG Compound HYOU1 protein SMILES [H][C@@]12C[C@@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 53-84-9 CAS Protein disulfide-isomerase A2 Protein disulfide-isomerase A2 78 kDa glucose-regulated protein 1.0 2.0 SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C(O)=C3 CHEBI:1156 ChEBI 482-67-7 CAS HYOU1 protein Cytochrome P450 1A1 NADP P14061 UniProt ReactionCatalysis64440 ACTIVATION CHEBI:17985 ChEBI DnaJ homolog subfamily B member 11 Estradiol Estrone Metabolism Endoplasmic Reticulum Membrane SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O 103012 ChemSpider C00951 KEGG Compound CHEBI:17980 ChEBI 5682 ChemSpider 362-08-3 CAS UDP BioCyc SMILES NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O C05299 KEGG Compound C05298 KEGG Compound 1.0 P04798 UniProt P30040 UniProt HMDB0000010 HMDB P22309 UniProt ReactionCatalysis64412 ACTIVATION 2.8.2.4 false 2.8.2.4 Estrone + Phosphoadenosine phosphosulfate → Adenosine 3',5'-diphosphate + Estrone sulfate LEFT_TO_RIGHT 103124 ChemSpider 5553 ChemSpider ReactionCatalysis64419 ACTIVATION HMDB0000935 HMDB 5554 ChemSpider 5675 ChemSpider S-Adenosylmethionine 2479-90-5 CAS HMDB0000939 HMDB C00167 KEGG Compound HMDB0000145 HMDB 1.0 1.0 Estradiol 17-beta-dehydrogenase 1 NAD C9H14N2O12P2 Uridine 5'-diphosphate 404.0022 2-Methoxyestrone 3-glucuronide ReactionCatalysis64401 ACTIVATION Reaction74260 false Estrone + Hydrogen Ion + NADPH + Oxygen → 16a-Hydroxyestrone + NADP + Water LEFT_TO_RIGHT 1.1.1.62 false 1.1.1.62 Estrone + Hydrogen Ion + NADPH ↔ Estradiol + NADP REVERSIBLE C10H15N5O13P2S Phosphoadenosine phosphosulfate 506.98624 1.0 Homo sapiens 140102 ChemSpider CPD-352 BioCyc ESTRONE BioCyc C00054 KEGG Compound C00053 KEGG Compound 388299 ChemSpider 7732-18-5 CAS 1.0 1.0 C18H22O2 Estrone 270.162 HMDB0001487 HMDB Water O2 Oxygen 31.98983 HSP90B1 protein GO:0005789 GENE ONTOLOGY Reaction74269 false 16a-Hydroxyestrone + Hydrogen Ion + NADH ↔ Estriol + NAD REVERSIBLE C18H24O2 Estradiol 272.17764 16522 ChemSpider HMDB0000151 HMDB HMDB0000153 HMDB NAD PW031778 PathWhiz Reaction74253 false Estradiol + Hydrogen Ion + NADPH + Oxygen → Estriol + NADP + Water LEFT_TO_RIGHT Estriol Estrogen sulfotransferase 10214 PubChem-compound 7782-44-7 CAS HMDB0001377 HMDB 1.0 HMDB0001134 HMDB SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H]1O S-Adenosylhomocysteine 115255 PubChem-compound 1.0 P20815 UniProt 1.0 9606 TAXONOMY 962 PubChem-compound 31983 ChemSpider 2-Methoxyestrone 1.0 53-16-7 CAS 58-98-0 CAS UDP-glucuronosyltransferase 1-1 SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OS(O)(=O)=O)[C@@H](OP(O)(O)=O)[C@H]1O 362-06-1 CAS 1.0 5893 PubChem-compound 1.0 PAPS BioCyc C00080 KEGG Compound 1.0 SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 SMILES O=O 22833612 PubChem-compound 1.0 17216256 ChemSpider HMDB0002111 HMDB HMDB0000295 HMDB SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 5809 ChemSpider CHEBI:15377 ChEBI CHEBI:15379 ChEBI 2-Methoxyestrone 1.0 CHEBI:15378 ChEBI SMILES [H+] 1.0 Reaction74232 false 2-Hydroxyestrone + S-Adenosylmethionine → 2-Methoxyestrone + S-Adenosylhomocysteine LEFT_TO_RIGHT CHEBI:16469 ChEBI C18H22O3 16a-Hydroxyestrone 286.1569 Estrone 2272513 ChemSpider 5886 PubChem-compound CHEBI:776 ChEBI Catechol O-methyltransferase 16a-Hydroxyestrone 1.0 1.0 115116 PubChem-compound C18H22O3 2-Hydroxyestrone 286.1569 2.4.1.17 false 2.4.1.17 Estrone + Uridine diphosphate glucuronic acid → Estrone glucuronide + Uridine 5'-diphosphate LEFT_TO_RIGHT 16a-Hydroxyestrone HMDB0000061 HMDB 2.4.1.17 false 2.4.1.17 2-Methoxyestrone + Uridine diphosphate glucuronic acid → 2-Methoxyestrone 3-glucuronide + Uridine 5'-diphosphate LEFT_TO_RIGHT 481-97-0 CAS Peptidyl-prolyl cis-trans isomerase B Reaction74221 false Estrone + Hydrogen Ion + NADH + Oxygen → 2-Hydroxyestrone + NAD + Water LEFT_TO_RIGHT 1.0 Estrone SMILES N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N)C(O)=O C05300 KEGG Compound SMP0030880 SMPDB SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O 25577-70-2 CAS 25246222 PubChem-compound 22833512 PubChem-compound P49888 UniProt ReactionCatalysis929 ACTIVATION H2O Water 18.010565 Estrogen sulfotransferase Estrone sulfate Uridine 5'-diphosphate NADH BioCyc NAD BioCyc NADP 977 PubChem-compound CHEBI:17659 ChEBI HMDB0059597 HMDB 1.0 1.0 CHEBI:16680 ChEBI Q15084 UniProt P23284 UniProt 24762165 PubChem-compound SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=CC(OC)=C(O[C@@H]4O[C@H](O)[C@@H](O)[C@H](O)[C@H]4O)C=C3CC[C@@]21[H] SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=CC=C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3CC[C@@]21[H] Phosphoadenosine phosphosulfate C18H24O3 Estriol 288.17255 1.0 Estrogen sulfotransferase Cytochrome P450 1A1 Catechol O- methyltransferase UDP- glucuronosyltransferase 1-1 UDP- glucuronosyltransferase 1-1 Estradiol 17-beta- dehydrogenase 1 Cytochrome P450 3A5 Estradiol 17-beta- dehydrogenase 1 Cytochrome P450 3A5 Estrone Phosphoadenosine phosphosulfate Estrone sulfate Adenosine 3',5'- diphosphate H + O 2 NADH 2- Hydroxyestrone NAD H 2 O S- Adenosylmethionine 2- Methoxyestrone S- Adenosylhomocysteine Uridine diphosphate glucuronic acid 2- Methoxyestrone 3-glucuronide Uridine 5'-diphosphate Uridine diphosphate glucuronic acid Estrone glucuronide Uridine 5'-diphosphate NADPH H + Estradiol NADP H + O 2 NADPH NADP H 2 O 16a- Hydroxyestrone NADH H + Estriol NAD H + O 2 NADPH NADP H 2 O Heme Magnesium Heme Heme Cytosol Endoplasmic Reticulum Membrane
17215925 ChemSpider 1.0 937 ChemSpider P13667 UniProt CHEBI:28919 ChEBI Catechol O-methyltransferase 1.0 439153 PubChem-compound 2-Hydroxyestrone SMILES O 1.0 ReactionCatalysis64393 ACTIVATION HMDB0001185 HMDB Stromal cell-derived factor 2-like protein 1 2616-64-0 CAS Cytochrome P450 3A5 NADPH Cytochrome P450 1A1 1.0 CHEBI:17474 ChEBI Uridine diphosphate glucuronic acid P21964 UniProt 1.0 SMILES [H][C@@]12C[C@@H](O)[C@H](O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 CHEBI:15846 ChEBI 1.0 C10H15N5O10P2 Adenosine 3',5'-diphosphate 427.02942 5870 PubChem-compound C15H23N6O5S S-Adenosylmethionine 399.14505 53-59-8 CAS C19H24O3 2-Methoxyestrone 300.17255 1.0 5756 PubChem-compound 5757 PubChem-compound NADH ESTRONE-SULFATE BioCyc 1038 PubChem-compound CHEBI:17200 ChEBI 1.0 Hydrogen Ion Endoplasmic reticulum resident protein 29 CHEBI:16474 ChEBI 952 ChemSpider GO:0005829 GENE ONTOLOGY C18H22O5S Estrone sulfate 350.1188 CHEBI:1189 ChEBI P11021 UniProt 566-76-7 CAS 1.0 CHEBI:16908 ChEBI C00468 KEGG Compound ADENOSYL-HOMO-CYS BioCyc UDP-GLUCURONATE BioCyc 6031 PubChem-compound Q6IN67 UniProt 485-80-3 CAS 1010 ChemSpider Estriol SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)N1C=CC(=O)NC1=O C21H30N7O17P3 NADPH 745.0911 3-5-ADP BioCyc HMDB0004483 HMDB HMDB0004482 HMDB C21H29N7O17P3 NADP 744.08325 Q9HCN8 UniProt Adenosine 3',5'-diphosphate C15H22N2O18P2 Uridine diphosphate glucuronic acid 580.0343 NADPH BioCyc 1053-73-2 CAS 1.0 C02538 KEGG Compound SMILES C[S+](CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N 979-92-0 CAS 1.0 Estradiol 17-beta-dehydrogenase 1 CHEBI:17263 ChEBI 2-Hydroxyestrone Cytosol CPD-6641 BioCyc SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C(OC)=C3 440624 PubChem-compound 3001028 PubChem-compound 440623 PubChem-compound 1.0 1.0 C14H20N6O5S S-Adenosylhomocysteine 384.12158 Cytochrome P450 3A5 58-68-4 CAS UDP-glucuronosyltransferase 1-1 HMDB0001425 HMDB HMDB0000335 HMDB HMDB0000217 HMDB SMILES C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(OS(O)(=O)=O)=C4)[C@@H]1CCC2=O 1.0 Q96GW1 UniProt 1.0 NADH C00007 KEGG Compound Oxygen C00006 KEGG Compound CHEBI:15414 ChEBI Hydrogen Ion CHEBI:18009 ChEBI Q13087 UniProt 50-28-2 CAS C00001 KEGG Compound Q9UBS4 UniProt 9799 ChemSpider Estrone glucuronide 1.0 C00005 KEGG Compound C00004 KEGG Compound C00003 KEGG Compound NADPH HMDB0000343 HMDB SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](OP(O)(O)=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O Protein disulfide-isomerase A6 C24H32O8 2-Methoxyestrone 3-glucuronide 448.20972 HMDB0000221 HMDB C24H30O8 Estrone glucuronide 446.19406 SMILES NC(=O)C1=CN(C=CC1)[C@H]1O[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H]2O[C@@H]([C@@H](OP(O)(O)=O)[C@H]2O)N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1O 159296 PubChem-compound 17473 PubChem-compound C05141 KEGG Compound C11133 KEGG Compound C11132 KEGG Compound Estradiol ReactionCatalysis64445 ACTIVATION 53-57-6 CAS C00019 KEGG Compound DnaJ homolog subfamily B member 11 Protein disulfide-isomerase A4 HSP90B1 protein 1.0 ReactionCatalysis64449 ACTIVATION C21H28N7O14P2 NAD 664.11694 S-ADENOSYLMETHIONINE BioCyc 1.0 78 kDa glucose-regulated protein HMDB0000902 HMDB C00015 KEGG Compound 5660 ChemSpider CHEBI:27974 ChEBI C21H29N7O14P2 NADH 665.12476 NAD(P) BioCyc Estrogen sulfotransferase 1.0 1.0 389514 ChemSpider H Hydrogen Ion 1.007825 50-27-1 CAS 388301 ChemSpider UDP-glucuronosyltransferase 1-1 ReactionCatalysis64433 ACTIVATION Stromal cell-derived factor 2-like protein 1 389515 ChemSpider Endoplasmic reticulum resident protein 29 Protein disulfide-isomerase A4 1.0 Protein disulfide-isomerase A6 Peptidyl-prolyl cis-trans isomerase B C00021 KEGG Compound HYOU1 protein SMILES [H][C@@]12C[C@@H](O)C(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 53-84-9 CAS Protein disulfide-isomerase A2 Protein disulfide-isomerase A2 78 kDa glucose-regulated protein 1.0 2.0 SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C(O)=C3 CHEBI:1156 ChEBI 482-67-7 CAS HYOU1 protein Cytochrome P450 1A1 NADP P14061 UniProt ReactionCatalysis64440 ACTIVATION CHEBI:17985 ChEBI DnaJ homolog subfamily B member 11 Estradiol Estrone Metabolism Endoplasmic Reticulum Membrane SMILES NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O 103012 ChemSpider C00951 KEGG Compound CHEBI:17980 ChEBI 5682 ChemSpider 362-08-3 CAS UDP BioCyc SMILES NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](CO[P@](O)(=O)O[P@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O C05299 KEGG Compound C05298 KEGG Compound 1.0 P04798 UniProt P30040 UniProt HMDB0000010 HMDB P22309 UniProt ReactionCatalysis64412 ACTIVATION 2.8.2.4 false 2.8.2.4 Estrone + Phosphoadenosine phosphosulfate → Adenosine 3',5'-diphosphate + Estrone sulfate LEFT_TO_RIGHT 103124 ChemSpider 5553 ChemSpider ReactionCatalysis64419 ACTIVATION HMDB0000935 HMDB 5554 ChemSpider 5675 ChemSpider S-Adenosylmethionine 2479-90-5 CAS HMDB0000939 HMDB C00167 KEGG Compound HMDB0000145 HMDB 1.0 1.0 Estradiol 17-beta-dehydrogenase 1 NAD C9H14N2O12P2 Uridine 5'-diphosphate 404.0022 2-Methoxyestrone 3-glucuronide ReactionCatalysis64401 ACTIVATION Reaction74260 false Estrone + Hydrogen Ion + NADPH + Oxygen → 16a-Hydroxyestrone + NADP + Water LEFT_TO_RIGHT 1.1.1.62 false 1.1.1.62 Estrone + Hydrogen Ion + NADPH ↔ Estradiol + NADP REVERSIBLE C10H15N5O13P2S Phosphoadenosine phosphosulfate 506.98624 1.0 Homo sapiens 140102 ChemSpider CPD-352 BioCyc ESTRONE BioCyc C00054 KEGG Compound C00053 KEGG Compound 388299 ChemSpider 7732-18-5 CAS 1.0 1.0 C18H22O2 Estrone 270.162 HMDB0001487 HMDB Water O2 Oxygen 31.98983 HSP90B1 protein GO:0005789 GENE ONTOLOGY Reaction74269 false 16a-Hydroxyestrone + Hydrogen Ion + NADH ↔ Estriol + NAD REVERSIBLE C18H24O2 Estradiol 272.17764 16522 ChemSpider HMDB0000151 HMDB HMDB0000153 HMDB NAD PW031778 PathWhiz Reaction74253 false Estradiol + Hydrogen Ion + NADPH + Oxygen → Estriol + NADP + Water LEFT_TO_RIGHT Estriol Estrogen sulfotransferase 10214 PubChem-compound 7782-44-7 CAS HMDB0001377 HMDB 1.0 HMDB0001134 HMDB SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H]1O S-Adenosylhomocysteine 115255 PubChem-compound 1.0 P20815 UniProt 1.0 9606 TAXONOMY 962 PubChem-compound 31983 ChemSpider 2-Methoxyestrone 1.0 53-16-7 CAS 58-98-0 CAS UDP-glucuronosyltransferase 1-1 SMILES NC1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(O)(=O)OS(O)(=O)=O)[C@@H](OP(O)(O)=O)[C@H]1O 362-06-1 CAS 1.0 5893 PubChem-compound 1.0 PAPS BioCyc C00080 KEGG Compound 1.0 SMILES [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 SMILES O=O 22833612 PubChem-compound 1.0 17216256 ChemSpider HMDB0002111 HMDB HMDB0000295 HMDB SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=C(CC[C@@]21[H])C=C(O)C=C3 5809 ChemSpider CHEBI:15377 ChEBI CHEBI:15379 ChEBI 2-Methoxyestrone 1.0 CHEBI:15378 ChEBI SMILES [H+] 1.0 Reaction74232 false 2-Hydroxyestrone + S-Adenosylmethionine → 2-Methoxyestrone + S-Adenosylhomocysteine LEFT_TO_RIGHT CHEBI:16469 ChEBI C18H22O3 16a-Hydroxyestrone 286.1569 Estrone 2272513 ChemSpider 5886 PubChem-compound CHEBI:776 ChEBI Catechol O-methyltransferase 16a-Hydroxyestrone 1.0 1.0 115116 PubChem-compound C18H22O3 2-Hydroxyestrone 286.1569 2.4.1.17 false 2.4.1.17 Estrone + Uridine diphosphate glucuronic acid → Estrone glucuronide + Uridine 5'-diphosphate LEFT_TO_RIGHT 16a-Hydroxyestrone HMDB0000061 HMDB 2.4.1.17 false 2.4.1.17 2-Methoxyestrone + Uridine diphosphate glucuronic acid → 2-Methoxyestrone 3-glucuronide + Uridine 5'-diphosphate LEFT_TO_RIGHT 481-97-0 CAS Peptidyl-prolyl cis-trans isomerase B Reaction74221 false Estrone + Hydrogen Ion + NADH + Oxygen → 2-Hydroxyestrone + NAD + Water LEFT_TO_RIGHT 1.0 Estrone SMILES N[C@@H](CCSC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N)C(O)=O C05300 KEGG Compound SMP0030880 SMPDB SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)O[C@H]([C@@H]1O)N1C=CC(=O)NC1=O 25577-70-2 CAS 25246222 PubChem-compound 22833512 PubChem-compound P49888 UniProt ReactionCatalysis929 ACTIVATION H2O Water 18.010565 Estrogen sulfotransferase Estrone sulfate Uridine 5'-diphosphate NADH BioCyc NAD BioCyc NADP 977 PubChem-compound CHEBI:17659 ChEBI HMDB0059597 HMDB 1.0 1.0 CHEBI:16680 ChEBI Q15084 UniProt P23284 UniProt 24762165 PubChem-compound SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=CC(OC)=C(O[C@@H]4O[C@H](O)[C@@H](O)[C@H](O)[C@H]4O)C=C3CC[C@@]21[H] SMILES [H][C@@]12CCC(=O)[C@@]1(C)CC[C@]1([H])C3=CC=C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3CC[C@@]21[H] Phosphoadenosine phosphosulfate C18H24O3 Estriol 288.17255 1.0