Summary

IMPPAT Phytochemical identifier: IMPHY016165

Phytochemical name: Decahydro-1,2-dimethylnaphthalene

Synonymous chemical names:
1,2-naphthalene decahydrodimethyl

External chemical identifiers:
CID:565551, SureChEMBL:SCHEMBL19711900

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Chemical structure information

SMILES:
CC1CCC2C(C1C)CCCC2

InChI:
InChI=1S/C12H22/c1-9-7-8-11-5-3-4-6-12(11)10(9)2/h9-12H,3-8H2,1-2H3

InChIKey:
FHEIPFHZECVFRS-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC6C))CCCC6

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCC2CCCCC2C1

Scaffold Graph/Node level:
C1CCC2CCCCC2C1

Scaffold Graph level:
C1CCC2CCCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Polycyclic hydrocarbons

NP Classifier Biosynthetic pathway: Terpenoids

NP-Likeness score: 1.267

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Chemical structure download