Summary

IMPPAT Phytochemical identifier: IMPHY001771

Phytochemical name: Pristane

Synonymous chemical names:
2, 6, 10, 14-tetramethylpentadecane (pristane), 2,6,10,-tetramethylpentadecane (pristane), 2,6,10,14-tetramethyl-pentadecane, 2,6,10,14-tetramethylpentadecane, pristane

External chemical identifiers:
CID:15979, ChEBI:53181, FDASRS:26HZV48DT1, SureChEMBL:SCHEMBL20928

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Chemical structure information

SMILES:
CC(CCCC(C)C)CCCC(CCCC(C)C)C

InChI:
InChI=1S/C19H40/c1-16(2)10-7-12-18(5)14-9-15-19(6)13-8-11-17(3)4/h16-19H,7-15H2,1-6H3

InChIKey:
XOJVVFBFDXDTEG-UHFFFAOYSA-N

DeepSMILES:
CCCCCCC)C)))))CCCCCCCCC)C)))))C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Prenol lipids

ClassyFire Subclass: Diterpenoids

NP Classifier Biosynthetic pathway: Terpenoids

NP Classifier Superclass: Diterpenoids

NP Classifier Class: Phytane diterpenoids

NP-Likeness score: 0.472

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Chemical structure download