Summary

IMPPAT Phytochemical identifier: IMPHY015537

Phytochemical name: 1-Decanol, 5,9-dimethyl-

Synonymous chemical names:
c12h26o

External chemical identifiers:
CID:534457, MolPort-002-510-107

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Chemical structure information

SMILES:
OCCCCC(CCCC(C)C)C

InChI:
InChI=1S/C12H26O/c1-11(2)7-6-9-12(3)8-4-5-10-13/h11-13H,4-10H2,1-3H3

InChIKey:
VQNCGSXNEUQERP-UHFFFAOYSA-N

DeepSMILES:
OCCCCCCCCCC)C)))))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: 1.2

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Chemical structure download