Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID001034

Phytochemical name: 1-Undecanol

Synonymous chemical names:
1-undecanol, undecan-1-ol, 1-Undecanol, undecanol *, n-Undecanol, undecanol

External chemical identifiers:
CID:CID_8184, ChEMBL:CHEMBL444525, ChEBI:CHEBI:87499, ZINC:ZINC000001596062, FDASRS:06MJ0P28T3, SureChEMBL:SCHEMBL20655, MolPort-001-788-271

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Chemical structure information

SMILES:
CCCCCCCCCCCO

InChI:
InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3

InChIKey:
KJIOQYGWTQBHNH-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCO

Functional groups:
CO

Link to spectral information:
MSBNK-Fac_Eng_Univ_Tokyo-JP001332

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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: 0.625

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Chemical structure download