Summary

IMPPAT Phytochemical identifier: IMPHY005737

Phytochemical name: 20-Tetratriacontene-2-one

Synonymous chemical names:
20-tetratriacontene-2-one

External chemical identifiers:
CID:56637991

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Chemical structure information

SMILES:
CCCCCCCCCCCCCC=CCCCCCCCCCCCCCCCCCC(=O)C

InChI:
InChI=1S/C34H66O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34(2)35/h15-16H,3-14,17-33H2,1-2H3

InChIKey:
WWQYYFVPMJEECJ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCC=CCCCCCCCCCCCCCCCCCC=O)C

Functional groups:
CC(C)=O, CC=CC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbonyl compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Oxygenated hydrocarbons

NP-Likeness score: 0.505

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Chemical structure download