Stachatranone C (CHEBI:224448)

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CHEBI:224448 - Stachatranone C

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ChEBI ID	CHEBI:224448
ChEBI Name	Stachatranone C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H30O4
Net Charge	0
Average Mass	334.456
Monoisotopic Mass	334.21441
SMILES	C/C1=C\[C@H](O)[C@H](O)/C(C)=C/C[C@@]2(C)OC(=O)C=C(C(C)C)[C@@H]2CC1
InChI	InChI=1S/C20H30O4/c1-12(2)15-11-18(22)24-20(5)9-8-14(4)19(23)17(21)10-13(3)6-7-16(15)20/h8,10-12,16-17,19,21,23H,6-7,9H2,1-5H3/b13-10+,14-8+/t16-,17-,19+,20+/m0/s1
InChIKey	LEHBPHLHJODCFQ-IQZQZOBXSA-N

Species of Metabolite	Component	Source	Comments
Stachybotrys chartarum (ncbitaxon:74722)	-	PubMed (31265296)

ChEBI Ontology

Outgoing Relation(s)
	Stachatranone C (CHEBI:224448) is a pyranone (CHEBI:37963)

IUPAC Name
(1S,4E,6S,7R,8E,11R)-6,7-dihydroxy-4,8,11-trimethyl-15-propan-2-yl-12-oxabicyclo[9.4.0]pentadeca-4,8,14-trien-13-one

Manual Xrefs	Databases
77089189	ChemSpider