Summary

IMPPAT Phytochemical identifier: IMPHY017547

Phytochemical name: 5,6-Decadien-3-yne, 5,7-diethyl-

Synonymous chemical names:
5,6-decadien-3-yne,l 5,7-diethy

External chemical identifiers:
CID:595131

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Chemical structure information

SMILES:
CCC#CC(=C=C(CCC)CC)CC

InChI:
InChI=1S/C14H22/c1-5-9-11-14(8-4)12-13(7-3)10-6-2/h5-8,10H2,1-4H3

InChIKey:
HFTHVMPRQHDBBN-UHFFFAOYSA-N

DeepSMILES:
CCC#CC=C=CCCC)))CC))))CC

Functional groups:
CC#CC(C)=C=C(C)C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Branched unsaturated hydrocarbons

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 1.538

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Chemical structure download