Summary

IMPPAT Phytochemical identifier: IMPHY013555

Phytochemical name: 25-Methyl-10-triacontanone

Synonymous chemical names:
25-methyl triacont-10-one, 25-methyltriacontan-10-one

External chemical identifiers:
CID:86172607

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Chemical structure information

SMILES:
CCCCCCCCCC(=O)CCCCCCCCCCCCCCC(CCCCC)C

InChI:
InChI=1S/C31H62O/c1-4-6-8-9-16-20-24-28-31(32)29-25-21-18-15-13-11-10-12-14-17-19-23-27-30(3)26-22-7-5-2/h30H,4-29H2,1-3H3

InChIKey:
BRSOYKIAEJTKCP-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC=O)CCCCCCCCCCCCCCCCCCCC)))))C

Functional groups:
CC(C)=O

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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: 0.484

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Chemical structure download