LL-N313ζ (CHEBI:222061)

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CHEBI:222061 - LL-N313ζ

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ChEBI ID	CHEBI:222061
ChEBI Name	LL-N313ζ
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Submitter	MetaboLights
Downloads	Molfile

Formula	C16H22O3
Net Charge	0
Average Mass	262.349
Monoisotopic Mass	262.15689
SMILES	C[C@@H]1C=C2C=C[C@@]3(C)OCCC(=O)[C@@]3(C)[C@H]2[C@@H](O)C1
InChI	InChI=1S/C16H22O3/c1-10-8-11-4-6-15(2)16(3,13(18)5-7-19-15)14(11)12(17)9-10/h4,6,8,10,12,14,17H,5,7,9H2,1-3H3/t10-,12+,14-,15-,16+/m1/s1
InChIKey	SXHZNZFKZCCMFJ-PIVDIINCSA-N

Species of Metabolite	Component	Source	Comments
Sporormiella affinis (ncbitaxon:718230)	-	PubMed (4814757)

ChEBI Ontology

Outgoing Relation(s)
	LL-N313ζ (CHEBI:222061) is a organic heterotricyclic compound (CHEBI:26979)
	LL-N313ζ (CHEBI:222061) is a organooxygen compound (CHEBI:36963)

IUPAC Name
(4aR,8S,10S,10aS,10bS)-10-hydroxy-4a,8,10b-trimethyl-2,3,8,9,10,10a-hexahydrobenzo[]chromen-1-one

Manual Xrefs	Databases
166107	ChemSpider