CHEBI:91584 - sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester

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ChEBI Name sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
ChEBI ID CHEBI:91584
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C18H22O5S
Net Charge 0
Average Mass 350.431
Monoisotopic Mass 350.11879
InChI InChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)/t14?,15?,16?,18-/m0/s1
InChIKey JKKFKPJIXZFSSB-GUZDXLFXSA-N
SMILES C[C@]12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)O
ChEBI Ontology
Outgoing sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester (CHEBI:91584) is a steroid sulfate (CHEBI:16158)
Manual Xref Database
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