Summary

IMPPAT Phytochemical identifier: IMPHY016777

Phytochemical name: Nona-1,3-diene

Synonymous chemical names:
nonadiene

External chemical identifiers:
CID:41971

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Chemical structure information

SMILES:
CCCCCC=CC=C

InChI:
InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3,5,7H,1,4,6,8-9H2,2H3

InChIKey:
CLNYHERYALISIR-UHFFFAOYSA-N

DeepSMILES:
CCCCCC=CC=C

Functional groups:
C=CC=CC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Olefins

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 2.431

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Chemical structure download