Secobotrytriendiol (CHEBI:210972)

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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	Secobotrytriendiol

ChEBI ID	CHEBI:210972

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O2

Net Charge

Average Mass

236.355

Monoisotopic Mass

236.17763

InChI

InChI=1S/C15H24O2/c1-6-11(8-16)13-12(7-2)14(3,4)9-15(13,5)10-17/h6-7,16-17H,2,8-10H2,1,3-5H3/b11-6-/t15-/m1/s1

InChIKey

BHNACKMCMDASDB-UJNBGNEJSA-N

SMILES

OC/C(/C1=C(C=C)C(C)(C)C[C@@]1(CO)C)=C/C

Metabolite of Species	Details
Botrytis cinerea (NCBI:txid40559)	See: PubMed

ChEBI Ontology
Outgoing	Secobotrytriendiol (CHEBI:210972) is a monoterpenoid (CHEBI:25409)

IUPAC Name

(E)-2-[(5S)-2-ethenyl-5-(hydroxymethyl)-3,3,5-trimethylcyclopenten-1-yl]but-2-en-1-ol