CHEBI:91653 - benzoic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester

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ChEBI Name benzoic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester
ChEBI ID CHEBI:91653
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H28O3
Net Charge 0
Average Mass 376.489
Monoisotopic Mass 376.20384
InChI InChI=1S/C25H28O3/c1-25-14-13-20-19-10-8-18(28-24(27)16-5-3-2-4-6-16)15-17(19)7-9-21(20)22(25)11-12-23(25)26/h2-6,8,10,15,20-23,26H,7,9,11-14H2,1H3
InChIKey UYIFTLBWAOGQBI-UHFFFAOYSA-N
SMILES CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5
ChEBI Ontology
Outgoing benzoic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester (CHEBI:91653) has parent hydride estrane (CHEBI:23966)
benzoic acid (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) ester (CHEBI:91653) is a steroid (CHEBI:35341)
Manual Xref Database
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