Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000256

Phytochemical name: Geraniol

Synonymous chemical names:
trans geraniol, geraniol (in mixture), Geraniol, trans-geraniol, geraniol

External chemical identifiers:
CID:CID_637566, ChEMBL:CHEMBL25719, ChEBI:CHEBI:17447, ZINC:ZINC000001529210, FDASRS:L837108USY, SureChEMBL:SCHEMBL19824, MolPort-001-769-751

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Chemical structure information

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

InChI:
InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+

InChIKey:
GLZPCOQZEFWAFX-JXMROGBWSA-N

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

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids

NP-Likeness score: 2.905

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Chemical structure download