Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018137

Phytochemical name: Heneicosane, 11-decyl-

Synonymous chemical names:
Heneicosane, 11-decyl-

External chemical identifiers:
CID:CID_143269

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Chemical structure information

SMILES:
CCCCCCCCCCC(CCCCCCCCCC)CCCCCCCCCC

InChI:
InChI=1S/C31H64/c1-4-7-10-13-16-19-22-25-28-31(29-26-23-20-17-14-11-8-5-2)30-27-24-21-18-15-12-9-6-3/h31H,4-30H2,1-3H3

InChIKey:
BCWYKEQUGMQGAP-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCC))))))))))CCCCCCCCCC

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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: 0.329

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Chemical structure download