Cyclonerodiol (CHEBI:197613)

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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	Cyclonerodiol

ChEBI ID	CHEBI:197613

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H28O2

Net Charge

Average Mass

240.387

Monoisotopic Mass

240.20893

InChI

InChI=1S/C15H28O2/c1-11(2)7-6-9-15(5,17)13-8-10-14(4,16)12(13)3/h7,12-13,16-17H,6,8-10H2,1-5H3/t12-,13+,14+,15+/m0/s1

InChIKey

ZBJPVPFEDGYYBD-GBJTYRQASA-N

SMILES

O[C@]1([C@H]([C@H]([C@](O)(CCC=C(C)C)C)CC1)C)C

ChEBI Ontology
Outgoing	Cyclonerodiol (CHEBI:197613) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name

(1R,2S,3R)-3-[(2R)-2-hydroxy-6-methylhept-5-en-2-yl]-1,2-dimethylcyclopentan-1-ol