Summary

IMPPAT Phytochemical identifier: IMPHY005880

Phytochemical name: Nona-1,3,5,7-tetraene

Synonymous chemical names:
3,5,7,9-tetrayne

External chemical identifiers:
CID:53791253

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Chemical structure information

SMILES:
CC=CC=CC=CC=C

InChI:
InChI=1S/C9H12/c1-3-5-7-9-8-6-4-2/h3-9H,1H2,2H3

InChIKey:
HRRORGQIZRYJFZ-UHFFFAOYSA-N

DeepSMILES:
CC=CC=CC=CC=C

Functional groups:
C=CC=CC=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: Fatty aldehydes

NP-Likeness score: 1.769

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Chemical structure download