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InChIKey | YUHVBHDSVLKFNI-NJSLBKSFSA-N |
InChI | InChI=1S/C19H24O4/c1-11-3-7-16(21)18(23)12(11)4-5-13-14-6-8-17(22)19(14,2)10-9-15(13)20/h3,7,13-14,21,23H,4-6,8-10H2,1-2H3/t13-,14-,19-/m0/s1 |
SMILES | Cc1ccc(O)c(O)c1CC[C@H]1[C@@H]2CCC(=O)[C@@]2(C)CCC1=O |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 3 |
Distinct compatimentalized reactions in models | 0 |
Identifier | Description |
---|---|
chebi:15896 | 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione |
seedM:cpd02912 | 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione 3,4-DHSA 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione |
metacycM:CPD-13709 | 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione 3,4-DHSA |
envipath:...a34b713dabcb keggC:C04793 | 3,4-Dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione |
lipidmaps:LMST02020062 slm:000390222 | 3,4-dihydroxy-9,10-secoandrosta-1,3,5(10)-triene-9,17-dione |
chebi:11690 chebi:1376 chebi:19876 keggC:M_C04793 seedM:M_cpd02912 | secondary/obsolete/fantasy identifier |