Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID014250

Phytochemical name: 1,3-Hexadiene, (Z)-

Synonymous chemical names:
(z)-1,3-hexadiene

External chemical identifiers:
CID:CID_5462879, ZINC:ZINC000071875376, SureChEMBL:SCHEMBL1760692

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Chemical structure information

SMILES:
CC/C=C\C=C

InChI:
InChI=1S/C6H10/c1-3-5-6-4-2/h3,5-6H,1,4H2,2H3/b6-5-

InChIKey:
AHAREKHAZNPPMI-WAYWQWQTSA-N

DeepSMILES:
CC/C=C\C=C

Functional groups:
C=C/C=C\C

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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-Likeness score: 2.817

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Chemical structure download