Summary

IMPPAT Phytochemical identifier: IMPHY014437

Phytochemical name: 1,28-Octacosanediol

Synonymous chemical names:
octacosane-1,28-diol

External chemical identifiers:
CID:54082727, ZINC:ZINC000014616203, SureChEMBL:SCHEMBL8625706

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Chemical structure information

SMILES:
OCCCCCCCCCCCCCCCCCCCCCCCCCCCCO

InChI:
InChI=1S/C28H58O2/c29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30/h29-30H,1-28H2

InChIKey:
MOGIDESHHYPDTP-UHFFFAOYSA-N

DeepSMILES:
OCCCCCCCCCCCCCCCCCCCCCCCCCCCCO

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: 0.207

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Chemical structure download