Omphadiol (CHEBI:227702)

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CHEBI:227702 - Omphadiol

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ChEBI ID	CHEBI:227702
ChEBI Name	Omphadiol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H26O2
Net Charge	0
Average Mass	238.371
Monoisotopic Mass	238.19328
SMILES	CC1(C)C[C@H]2[C@@H](CC[C@@]2(C)O)[C@]2(C)CC2[C@H]1O
InChI	InChI=1S/C15H26O2/c1-13(2)7-10-9(5-6-15(10,4)17)14(3)8-11(14)12(13)16/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11?,12-,14+,15-/m1/s1
InChIKey	BFAVGMXYYRUDRR-VDQJCRHBSA-N

Species of Metabolite	Component	Source	Comments
Omphalotus illudens (ncbitaxon:85975)	-	DOI (10.1021/np9904760)

ChEBI Ontology

Outgoing Relation(s)
	Omphadiol (CHEBI:227702) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
(2R,4aS,5R,7aR,7bS)-3,3,5,7b-tetramethyl-1,1a,2,4,4a,6,7,7a-octahydrocyclopropa[e]azulene-2,5-diol

Manual Xrefs	Databases
78437841	ChemSpider