Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID005576

Phytochemical name: 2-Decanol

Synonymous chemical names:
2-decyl-alcohol, 2-decanol, 2- decanol, decan-2-ol

External chemical identifiers:
CID:CID_14254, ChEMBL:CHEMBL46477, SureChEMBL:SCHEMBL161083

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Chemical structure information

SMILES:
CCCCCCCCC(O)C

InChI:
InChI=1S/C10H22O/c1-3-4-5-6-7-8-9-10(2)11/h10-11H,3-9H2,1-2H3

InChIKey:
ACUZDYFTRHEKOS-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCO)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

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.158

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Chemical structure download