Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID003813

Phytochemical name: 9-Hydroxygeraniol

Synonymous chemical names:
9-hydroxygeraniol (vi), 9-hydroxygeraniol

External chemical identifiers:
CID:CID_13619433, SureChEMBL:SCHEMBL10323892

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Chemical structure information

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

InChI:
InChI=1S/C10H18O2/c1-9(6-7-11)4-3-5-10(2)8-12/h5-6,11-12H,3-4,7-8H2,1-2H3/b9-6+,10-5-

InChIKey:
PREUOUJFXMCMSJ-KWNZIKDBSA-N

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

Functional groups:
CO, C/C=C(/C)C, C/C=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: 2.976

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Chemical structure download