IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
1-Nonadecanol
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY012249
Phytochemical name:
1-Nonadecanol
Synonymous chemical names:
1-nonadecanol, l-nonadecanol, nonadecanol, nonadecanol*
External chemical identifiers:
CID:80281
,
ZINC:ZINC000043504481
,
FDASRS:A465X576KO
,
SureChEMBL:SCHEMBL103937
,
MolPort-003-929-237
Chemical structure information
SMILES:
CCCCCCCCCCCCCCCCCCCO
InChI:
InChI=1S/C19H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h20H,2-19H2,1H3
InChIKey:
XGFDHKJUZCCPKQ-UHFFFAOYSA-N
DeepSMILES:
CCCCCCCCCCCCCCCCCCCO
Functional groups:
CO
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:
0.375
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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