Summary

IMPPAT Phytochemical identifier: IMPHY017213

Phytochemical name: 4-Nonanol

Synonymous chemical names:
4-nonanol

External chemical identifiers:
CID:22217, SureChEMBL:SCHEMBL510814, MolPort-003-911-143

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Chemical structure information

SMILES:
CCCCCC(CCC)O

InChI:
InChI=1S/C9H20O/c1-3-5-6-8-9(10)7-4-2/h9-10H,3-8H2,1-2H3

InChIKey:
IXUOEGRSQCCEHB-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCC)))O

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

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.498

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Chemical structure download