Summary

IMPPAT Phytochemical identifier: IMPHY017467

Phytochemical name: 2,6-Dimethyl-6-(4-methyl-3-pentenyl)-2-cyclohexene-1-carbaldehyde

Synonymous chemical names:
2,6-dimethyl-6-(4-methyl-3-pentenyl)-2-cyclohexene-1-carbaldehyde

External chemical identifiers:
CID:550290

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Chemical structure information

SMILES:
O=CC1C(=CCCC1(C)CCC=C(C)C)C

InChI:
InChI=1S/C15H24O/c1-12(2)7-5-9-15(4)10-6-8-13(3)14(15)11-16/h7-8,11,14H,5-6,9-10H2,1-4H3

InChIKey:
GRFURJUXEIHENU-UHFFFAOYSA-N

DeepSMILES:
O=CCC=CCCC6C)CCC=CC)C)))))))))C

Functional groups:
CC=C(C)C, CC=O

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCCC1

Scaffold Graph/Node level:
C1CCCCC1

Scaffold Graph level:
C1CCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organic oxides

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Sesquiterpenoids

NP-Likeness score: 2.937

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Chemical structure download