Summary

IMPPAT Phytochemical identifier: IMPHY010163

Phytochemical name: Filfiline

Synonymous chemical names:
filfiline

External chemical identifiers:
CID:131751108, ZINC:ZINC000085649606

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Chemical structure information

SMILES:
CCCCCCCCCCC/C=CCCCC/C=CC=C/C(=O)NCC(C)C

InChI:
InChI=1S/C26H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)27-24-25(2)3/h14-15,20-23,25H,4-13,16-19,24H2,1-3H3,(H,27,28)/b15-14-,21-20-,23-22-

InChIKey:
KDMZDJSBTQFEKT-RUAVVDHUSA-N

DeepSMILES:
CCCCCCCCCCC/C=CCCCC/C=CC=C/C=O)NCCC)C

Functional groups:
C/C=CC, C/C=CC=C/C(=O)NC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic acids and derivatives

ClassyFire Class: Carboximidic acids and derivatives

ClassyFire Subclass: Carboximidic acids

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty amides

NP Classifier Class: N-acyl amines

NP-Likeness score: 0.725

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Chemical structure download