(+)-(R)-grifolinone C (CHEBI:198926)

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CHEBI:198926 - (+)-(R)-grifolinone C

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ChEBI ID	CHEBI:198926
ChEBI Name	(+)-(R)-grifolinone C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C44H60O5
Net Charge	0
Average Mass	668.959
Monoisotopic Mass	668.44408
SMILES	CC(C)=CCC/C(C)=C/CC/C(C)=C/CC1=C(O)C(c2c(C)cc(O)c(C/C=C(\C)CC/C=C(\C)CCC=C(C)C)c2O)=C(C)C(=O)C1=O
InChI	InChI=1S/C44H60O5/c1-28(2)15-11-17-30(5)19-13-21-32(7)23-25-36-38(45)27-34(9)39(42(36)47)40-35(10)41(46)44(49)37(43(40)48)26-24-33(8)22-14-20-31(6)18-12-16-29(3)4/h15-16,19-20,23-24,27,45,47-48H,11-14,17-18,21-22,25-26H2,1-10H3/b30-19+,31-20+,32-23+,33-24+
InChIKey	XGBVAJXDAQBRLB-OAEQVLRSSA-N

Species of Metabolite	Component	Source	Comments
Albatrellopsis confluens (ncbitaxon:2925186)	-	PubMed (18357556)

ChEBI Ontology

Outgoing Relation(s)
	(+)-(R)-grifolinone C (CHEBI:198926) is a diterpenoid (CHEBI:23849)

IUPAC Name
4-[2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]phenyl]-5-hydroxy-3-methyl-6-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]cyclohexa-3,5-diene-1,2-dione

Manual Xrefs	Databases
78435573	ChemSpider