Summary

IMPPAT Phytochemical identifier: IMPHY014882

Phytochemical name: (+)-Linalool

Synonymous chemical names:
(+)-linalool, coriandrol, d-linalool, essential oil (coriandrol), linalool, (+)

External chemical identifiers:
CID:67179, ChEMBL:CHEMBL4452537, ChEBI:98, ZINC:ZINC000001529819, FDASRS:F4VNO44C09, SureChEMBL:SCHEMBL254425

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Chemical structure information

SMILES:
C=C[C@](CCC=C(C)C)(O)C

InChI:
InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3/t10-/m1/s1

InChIKey:
CDOSHBSSFJOMGT-SNVBAGLBSA-N

DeepSMILES:
C=C[C@]CCC=CC)C)))))O)C

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

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Monoterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids

NP-Likeness score: 3.045

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Chemical structure download