Summary

IMPPAT Phytochemical identifier: IMPHY016160

Phytochemical name: 1,12-Tridecadiene

Synonymous chemical names:
1,12-tridecadiene

External chemical identifiers:
CID:30874, ChEBI:151033, SureChEMBL:SCHEMBL219063

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Chemical structure information

SMILES:
C=CCCCCCCCCCC=C

InChI:
InChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-4H,1-2,5-13H2

InChIKey:
BPHFKBMQSYYNGQ-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCCCCC=C

Functional groups:
C=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: 0.681

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Chemical structure download