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IMPPAT Phytochemical information:
2-Tetradecanol
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY016288
Phytochemical name:
2-Tetradecanol
Synonymous chemical names:
2-tetradecanol
External chemical identifiers:
CID:20831
,
ChEMBL:CHEMBL449586
,
ChEBI:84284
,
SureChEMBL:SCHEMBL258879
,
MolPort-003-959-830
Chemical structure information
SMILES:
CCCCCCCCCCCCC(O)C
InChI:
InChI=1S/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14-15H,3-13H2,1-2H3
InChIKey:
BRGJIIMZXMWMCC-UHFFFAOYSA-N
DeepSMILES:
CCCCCCCCCCCCCO)C
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:
0.849
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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