Summary

IMPPAT Phytochemical identifier: IMPHY015615

Phytochemical name: 1-Methyl-4-(6-methylheptan-2-yl)benzene

Synonymous chemical names:
dihydrocurcumene

External chemical identifiers:
CID:577053

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Chemical structure information

SMILES:
CC(CCCC(c1ccc(cc1)C)C)C

InChI:
InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h8-12,14H,5-7H2,1-4H3

InChIKey:
GVCHCLNHTASCCP-UHFFFAOYSA-N

DeepSMILES:
CCCCCCcccccc6))C)))))C)))))C

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1ccccc1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Sesquiterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP Classifier Class: Bisabolane sesquiterpenoids

NP-Likeness score: 0.086

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Chemical structure download