Summary

IMPPAT Phytochemical identifier: IMPHY016092

Phytochemical name: 5,6-Dimethyldecane

Synonymous chemical names:
(r) decane,5,6-dimethyl-

External chemical identifiers:
CID:519255, SureChEMBL:SCHEMBL3185161

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Chemical structure information

SMILES:
CCCCC(C(CCCC)C)C

InChI:
InChI=1S/C12H26/c1-5-7-9-11(3)12(4)10-8-6-2/h11-12H,5-10H2,1-4H3

InChIKey:
NCJIZIYQFWXMFZ-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC))))C))C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.609

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Chemical structure download