CHEBI:38405 - antiogenin

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ChEBI Name antiogenin
ChEBI ID CHEBI:38405
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C23H34O6
Net Charge 0
Average Mass 406.51246
Monoisotopic Mass 406.23554
InChI InChI=1S/C23H34O6/c1-20-6-3-14(24)11-22(20,27)7-4-16-17(20)10-18(25)21(2)15(5-8-23(16,21)28)13-9-19(26)29-12-13/h9,14-18,24-25,27-28H,3-8,10-12H2,1-2H3/t14-,15+,16+,17-,18+,20+,21-,22-,23-/m0/s1
InChIKey ULRMPWVHLRZNOY-CFVFHYIWSA-N
SMILES [H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4(O)C[C@@H](O)CC[C@]4(C)[C@@]3([H])C[C@@H](O)[C@]12C)C1=CC(=O)OC1
ChEBI Ontology
Outgoing antiogenin (CHEBI:38405) has parent hydride 5β-cardanolide (CHEBI:35542)
antiogenin (CHEBI:38405) is a 12β-hydroxy steroid (CHEBI:36847)
antiogenin (CHEBI:38405) is a 14β-hydroxy steroid (CHEBI:36862)
antiogenin (CHEBI:38405) is a 3β-hydroxy steroid (CHEBI:36836)
antiogenin (CHEBI:38405) is a 5β-hydroxy steroid (CHEBI:38195)
Incoming antioside (CHEBI:28373) has functional parent antiogenin (CHEBI:38405)
IUPAC Name
3β,5,12β,14-tetrahydroxy-5β-card-20(22)-enolide
Registry Number Type Source
1692913 Beilstein Registry Number Beilstein
Last Modified
04 June 2007