Summary

IMPPAT Phytochemical identifier: IMPHY017149

Phytochemical name: 4-Decanol

Synonymous chemical names:
4-decanol

External chemical identifiers:
CID:16320, SureChEMBL:SCHEMBL77285, MolPort-006-113-928

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Chemical structure information

SMILES:
CCCCCCC(CCC)O

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

InChIKey:
DTDMYWXTWWFLGJ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC)))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: 1.459

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Chemical structure download