Summary

IMPPAT Phytochemical identifier: IMPHY017570

Phytochemical name: Undeca-1,3,5-triene

Synonymous chemical names:
undeca-1,3,5-triene

External chemical identifiers:
CID:61832, SureChEMBL:SCHEMBL112031

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Chemical structure information

SMILES:
CCCCCC=CC=CC=C

InChI:
InChI=1S/C11H18/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10H2,2H3

InChIKey:
JQQDKNVOSLONRS-UHFFFAOYSA-N

DeepSMILES:
CCCCCC=CC=CC=C

Functional groups:
C=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: Hydrocarbons

NP-Likeness score: 2.391

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Chemical structure download