Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000627

Phytochemical name: cis,cis-Farnesol

Synonymous chemical names:
cis,cis-farnesol, (Z,Z)-farnesol, cis,cis-Farnesol, Farnesol,cis-, (z,z) farnesol, z,z-farnesol, (z,z)-farnesol, (Z,Z)-Farnesol, (Z, Z)-farnesol

External chemical identifiers:
CID:CID_1549107, ChEBI:CHEBI:42680, ZINC:ZINC000013507232, FDASRS:J03523NK03, SureChEMBL:SCHEMBL2935434

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Chemical structure information

SMILES:
OC/C=C(\CC/C=C(\CCC=C(C)C)/C)/C

InChI:
InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3/b14-9-,15-11-

InChIKey:
CRDAMVZIKSXKFV-FBXUGWQNSA-N

DeepSMILES:
OC/C=C\CC/C=C\CCC=CC)C)))))/C)))))/C

Functional groups:
CO, C/C=C(\C)C, CC=C(C)C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids, Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids, Farnesane sesquiterpenoids

NP-Likeness score: 2.191

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Chemical structure download