Summary

IMPPAT Phytochemical identifier: IMPHY007386

Phytochemical name: Panaxytriol

Synonymous chemical names:
panaxytriol

External chemical identifiers:
CID:93484

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Chemical structure information

SMILES:
CCCCCCCC(C(CC#CC#CC(C=C)O)O)O

InChI:
InChI=1S/C17H26O3/c1-3-5-6-7-10-13-16(19)17(20)14-11-8-9-12-15(18)4-2/h4,15-20H,2-3,5-7,10,13-14H2,1H3

InChIKey:
RDIMTXDFGHNINN-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCC#CC#CCC=C))O)))))))O))O

Functional groups:
C=CC, CC#CC#CC, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.436

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Chemical structure download