Applanone C (CHEBI:227368)

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CHEBI:227368 - Applanone C

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ChEBI ID	CHEBI:227368
ChEBI Name	Applanone C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C24H30O6
Net Charge	0
Average Mass	414.498
Monoisotopic Mass	414.20424
SMILES	CC(=O)C1=C[C@@H](O)[C@]2(C)[C@]1(C)C(=O)C=C1[C@@]2(O)C(=O)C[C@H]2C(C)(C)C(=O)CC[C@]12C
InChI	InChI=1S/C24H30O6/c1-12(25)13-9-18(28)23(6)22(13,5)17(27)11-15-21(4)8-7-16(26)20(2,3)14(21)10-19(29)24(15,23)30/h9,11,14,18,28,30H,7-8,10H2,1-6H3/t14-,18+,21-,22-,23+,24+/m0/s1
InChIKey	OYKXWLQGJMIRTL-PTWPCQPQSA-N

Species of Metabolite	Component	Source	Comments
Ganoderma applanatum (ncbitaxon:29884)	-	PubMed (30390604)

ChEBI Ontology

Outgoing Relation(s)
	Applanone C (CHEBI:227368) is a 20-oxo steroid (CHEBI:36885)

IUPAC Name
(5R,8S,10S,13S,14S,15R)-17-acetyl-8,15-dihydroxy-4,4,10,13,14-pentamethyl-2,5,6,15-tetrahydro-1H-cyclopenta[a]phenanthrene-3,7,12-trione