Butyl lucidenate A (CHEBI:199034)

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CHEBI:199034 - Butyl lucidenate A

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ChEBI ID	CHEBI:199034
ChEBI Name	Butyl lucidenate A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C31H46O6
Net Charge	0
Average Mass	514.703
Monoisotopic Mass	514.32944
SMILES	CCCCOC(=O)CC[C@@H](C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
InChI	InChI=1S/C31H46O6/c1-8-9-14-37-25(36)11-10-18(2)19-15-24(35)31(7)27-20(32)16-22-28(3,4)23(34)12-13-29(22,5)26(27)21(33)17-30(19,31)6/h18-20,22,32H,8-17H2,1-7H3/t18-,19-,20+,22+,29+,30-,31+/m1/s1
InChIKey	VTRNTNWDQWDREE-UGUHEFQYSA-N

Species of Metabolite	Component	Source	Comments
Ganoderma lucidum (ncbitaxon:5315)	-	PubMed (20039640)

ChEBI Ontology

Outgoing Relation(s)
	Butyl lucidenate A (CHEBI:199034) is a triterpenoid (CHEBI:36615)

IUPAC Name
butyl (4R)-4-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pentanoate

Manual Xrefs	Databases
24661253	ChemSpider