Summary

IMPPAT Phytochemical identifier: IMPHY012264

Phytochemical name: 1,14-Tetradecanediol

Synonymous chemical names:
1,14-tetradecanediol

External chemical identifiers:
CID:88261, ZINC:ZINC000004202510, SureChEMBL:SCHEMBL158466, MolPort-001-759-804

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Chemical structure information

SMILES:
OCCCCCCCCCCCCCCO

InChI:
InChI=1S/C14H30O2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h15-16H,1-14H2

InChIKey:
XLKZJJVNBQCVIX-UHFFFAOYSA-N

DeepSMILES:
OCCCCCCCCCCCCCCO

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: 0.387

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Chemical structure download