Summary

IMPPAT Phytochemical identifier: IMPHY003121

Phytochemical name: Octacosanal

Synonymous chemical names:
octacosanal

External chemical identifiers:
CID:3084376, ChEBI:78441, SureChEMBL:SCHEMBL1696133

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCC=O

InChI:
InChI=1S/C28H56O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29/h28H,2-27H2,1H3

InChIKey:
LVXORIXZNUNHGQ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCC=O

Functional groups:
CC=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty aldehydes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty aldehydes

NP-Likeness score: 0.478

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Chemical structure download