Pallidopenilline G (CHEBI:228101)

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CHEBI:228101 - Pallidopenilline G

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ChEBI ID	CHEBI:228101
ChEBI Name	Pallidopenilline G
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C17H26O4
Net Charge	0
Average Mass	294.391
Monoisotopic Mass	294.18311
SMILES	CC(=O)OCCC(=O)[C@H]1C(C)=C[C@@H](O)[C@H]2C[C@@H](C)CC[C@H]12
InChI	InChI=1S/C17H26O4/c1-10-4-5-13-14(8-10)16(20)9-11(2)17(13)15(19)6-7-21-12(3)18/h9-10,13-14,16-17,20H,4-8H2,1-3H3/t10-,13-,14-,16+,17-/m0/s1
InChIKey	QFIGERUCAGJGAS-MSKFBYFHSA-N

Species of Metabolite	Component	Source	Comments
Penicillium thomii (ncbitaxon:36647)	-	PubMed (28006908)

ChEBI Ontology

Outgoing Relation(s)
	Pallidopenilline G (CHEBI:228101) is a carboxylic ester (CHEBI:33308)

IUPAC Name
[3-[(1R,4S,4aS,6S,8aS)-4-hydroxy-2,6-dimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-3-oxopropyl] acetate

Manual Xrefs	Databases
60596909	ChemSpider