Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID000129

Phytochemical name: 1-Decanol

Synonymous chemical names:
Decanol, n-Decanol, Decanol, 1, decanol, 1-decanol, 1-Decanol

External chemical identifiers:
CID:CID_8174, ChEMBL:CHEMBL25363, ChEBI:CHEBI:28903, ZINC:ZINC000001529247, FDASRS:89V4LX791F, SureChEMBL:SCHEMBL21645, MolPort-001-792-070

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Chemical structure information

SMILES:
CCCCCCCCCCO

InChI:
InChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3

InChIKey:
MWKFXSUHUHTGQN-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCO

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: 0.682

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Chemical structure download