Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID013385

Phytochemical name: Naphthalene, decahydro-1,6-dimethyl-

Synonymous chemical names:
1,6-naphthalene decahydrodimethyl

External chemical identifiers:
CID:CID_519434, SureChEMBL:SCHEMBL9441920

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Chemical structure information

SMILES:
CC1CCC2C(C1)CCCC2C

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

InChIKey:
SXLVBBLVYUOSKX-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC6)CCCC6C

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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: 1.322

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Chemical structure download