CHEBI:38248 - scillarenin

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ChEBI Name scillarenin
ChEBI ID CHEBI:38248
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H32O4
Net Charge 0
Average Mass 384.50848
Monoisotopic Mass 384.23006
InChI InChI=1S/C24H32O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,13-14,17-20,25,27H,4-5,7-12H2,1-2H3/t17-,18+,19-,20+,22-,23+,24-/m0/s1
InChIKey OVUOVMIMOCJILI-KFZANIOBSA-N
SMILES [H][C@@]1(CC[C@]2(O)[C@]3([H])CCC4=C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)c1ccc(=O)oc1
ChEBI Ontology
Outgoing scillarenin (CHEBI:38248) has functional parent bufanolide (CHEBI:22934)
scillarenin (CHEBI:38248) is a 14β-hydroxy steroid (CHEBI:36862)
scillarenin (CHEBI:38248) is a 3β-hydroxy steroid (CHEBI:36836)
Incoming scillaren A (CHEBI:27831) has functional parent scillarenin (CHEBI:38248)
IUPAC Name
3β,14-dihydroxybufa-4,20,22-trienolide
Synonyms Sources
beta-Scillarenin ChemIDplus
Cardiogenin ChemIDplus
Scillarenin A ChemIDplus
Registry Number Type Source
465-22-5 CAS Registry Number ChemIDplus
Last Modified
17 January 2023