Gilvsin A (CHEBI:217206)

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CHEBI:217206 - Gilvsin A

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ChEBI ID	CHEBI:217206
ChEBI Name	Gilvsin A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H50O2
Net Charge	0
Average Mass	454.739
Monoisotopic Mass	454.38108
SMILES	C=C(C[C@@H](O)[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3)C(C)C
InChI	InChI=1S/C31H50O2/c1-19(2)20(3)18-25(32)21(4)22-12-16-31(9)24-10-11-26-28(5,6)27(33)14-15-29(26,7)23(24)13-17-30(22,31)8/h19,21-22,25-26,32H,3,10-18H2,1-2,4-9H3/t21-,22+,25+,26-,29+,30+,31-/m0/s1
InChIKey	WCVBLXFGDKTIII-QPNNHYJZSA-N

Species of Metabolite	Component	Source	Comments
Fuscoporia gilva (ncbitaxon:40471)	-	PubMed (19261312)

ChEBI Ontology

Outgoing Relation(s)
	Gilvsin A (CHEBI:217206) is a triterpenoid (CHEBI:36615)

IUPAC Name
(5R,10S,13R,14R,17R)-17-[(2S,3R)-3-hydroxy-6-methyl-5-methylideneheptan-2-yl]-4,4,10,13,14-pentamethyl-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-one

Manual Xrefs	Databases
78441545	ChemSpider