Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018305

Phytochemical name: (E,Z)-2,6-Dimethylocta-2,4,6-triene

Synonymous chemical names:
(E,Z)-2,6-Dimethylocta-2,4,6-triene

External chemical identifiers:
CID:CID_5371125, ZINC:ZINC000077045808, FDASRS:7E8T33HY3A, SureChEMBL:SCHEMBL1305738

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Chemical structure information

SMILES:
C/C=C(\C=C\C=C(C)C)/C

InChI:
InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-4H3/b8-6+,10-5-

InChIKey:
GQVMHMFBVWSSPF-DAIHKBMKSA-N

DeepSMILES:
C/C=C\C=C\C=CC)C)))))/C

Functional groups:
C/C=C(C)\C=C\C=C(C)C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Monoterpenoids

NP Classifier Biosynthetic pathway: Fatty acids, Terpenoids

NP Classifier Superclass: Fatty acyls, Monoterpenoids

NP Classifier Class: Acyclic monoterpenoids, Hydrocarbons

NP-Likeness score: 2.833

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Chemical structure download