Summary

IMPPAT Phytochemical identifier: IMPHY017740

Phytochemical name: 3,7-Dimethyloctan-1-ol

Synonymous chemical names:
dihydro citronellol, dihydrocitronellol

External chemical identifiers:
CID:7792, ChEMBL:CHEMBL3181881, FDASRS:DPY9K1927C, SureChEMBL:SCHEMBL27965, MolPort-001-791-451

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Chemical structure information

SMILES:
OCCC(CCCC(C)C)C

InChI:
InChI=1S/C10H22O/c1-9(2)5-4-6-10(3)7-8-11/h9-11H,4-8H2,1-3H3

InChIKey:
PRNCMAKCNVRZFX-UHFFFAOYSA-N

DeepSMILES:
OCCCCCCCC)C)))))C

Functional groups:
CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids, Terpenoids

NP Classifier Superclass: Fatty acyls, Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids, Fatty alcohols

NP-Likeness score: 1.498

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Chemical structure download