Sundiversifolide (CHEBI:184491)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Sundiversifolide

ChEBI ID	CHEBI:184491

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H22O3

Net Charge

Average Mass

238.327

Monoisotopic Mass

238.15689

InChI

InChI=1S/C14H22O3/c1-9-8-13-12(10(2)14(16)17-13)6-5-11(9)4-3-7-15/h5,9-10,12-13,15H,3-4,6-8H2,1-2H3/t9-,10-,12+,13+/m0/s1

InChIKey

OXNJNKIMPIRBQC-YRRQLQLVSA-N

SMILES

O1[C@]2([C@@]([C@@H](C1=O)C)(CC=C([C@H](C2)C)CCCO)[H])[H]

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	Sundiversifolide (CHEBI:184491) is a terpene lactone (CHEBI:37668)

IUPAC Name

(3S,3aR,7S,8aR)-6-(3-hydroxypropyl)-3,7-dimethyl-3,3a,4,7,8,8a-hexahydrocyclohepta[b]uran-2-one