Summary

IMPPAT Phytochemical identifier: IMPHY015451

Phytochemical name: Isodecenal

Synonymous chemical names:
8-methyl 2-nonenal

External chemical identifiers:
CID:53903190

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Chemical structure information

SMILES:
O=CC=CCCCCC(C)C

InChI:
InChI=1S/C10H18O/c1-10(2)8-6-4-3-5-7-9-11/h5,7,9-10H,3-4,6,8H2,1-2H3

InChIKey:
HYNMWRBTSUNCDB-UHFFFAOYSA-N

DeepSMILES:
O=CC=CCCCCCC)C

Functional groups:
CC=CC=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: Fatty aldehydes

NP-Likeness score: 2.196

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Chemical structure download