Ganoderique acid Y (CHEBI:225857)

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CHEBI:225857 - Ganoderique acid Y

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ChEBI ID	CHEBI:225857
ChEBI Name	Ganoderique acid Y
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H46O3
Net Charge	0
Average Mass	454.695
Monoisotopic Mass	454.34470
SMILES	C/C(=C\CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=CCC4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@]12C)C(=O)O
InChI	InChI=1S/C30H46O3/c1-19(9-8-10-20(2)26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h10-11,14,19,21,24-25,31H,8-9,12-13,15-18H2,1-7H3,(H,32,33)/b20-10+/t19-,21-,24?,25+,28-,29-,30+/m1/s1
InChIKey	HUTCYUJPLOTDMX-BOSKRLFKSA-N

Species of Metabolite	Component	Source	Comments
Ganoderma lucidum (ncbitaxon:5315)	-	DOI (10.1016/s0040-4039(00)81610-x)

ChEBI Ontology

Outgoing Relation(s)
	Ganoderique acid Y (CHEBI:225857) is a triterpenoid (CHEBI:36615)

IUPAC Name
(E,6R)-6-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

Manual Xrefs	Databases
4476341	ChemSpider