IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
Nonanamide
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY015865
Phytochemical name:
Nonanamide
Synonymous chemical names:
nonanamide
External chemical identifiers:
CID:70709
,
ChEMBL:CHEMBL353209
,
ZINC:ZINC000001686933
,
FDASRS:0L1759048J
,
SureChEMBL:SCHEMBL38252
,
MolPort-002-478-972
Chemical structure information
SMILES:
CCCCCCCCC(=O)N
InChI:
InChI=1S/C9H19NO/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H2,10,11)
InChIKey:
GHLZUHZBBNDWHW-UHFFFAOYSA-N
DeepSMILES:
CCCCCCCCC=O)N
Functional groups:
CC(N)=O
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Lipids and lipid-like molecules
ClassyFire Class:
Fatty acyls
ClassyFire Subclass:
Fatty amides
NP Classifier Biosynthetic pathway:
Fatty acids
NP Classifier Superclass:
Fatty amides
NP Classifier Class:
Primary amides
NP-Likeness score:
0.086
Chemical structure download
2D:
2D MOL
2D MOL2
2D SDF
3D:
3D MOL
3D MOL2
3D SDF
3D PDB
3D PDBQT
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