IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
6-Deoxy-L-talose
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY010106
Phytochemical name:
6-Deoxy-L-talose
Synonymous chemical names:
6 deoxy-l-talose
External chemical identifiers:
CID:21123040
,
ZINC:ZINC000100052591
,
SureChEMBL:SCHEMBL570933
,
MolPort-044-561-774
Chemical structure information
SMILES:
O=C[C@@H]([C@@H]([C@@H]([C@@H](O)C)O)O)O
InChI:
InChI=1S/C6H12O5/c1-3(8)5(10)6(11)4(9)2-7/h2-6,8-11H,1H3/t3-,4-,5+,6-/m0/s1
InChIKey:
PNNNRSAQSRJVSB-AZGQCCRYSA-N
DeepSMILES:
O=C[C@@H][C@@H][C@@H][C@@H]O)C))O))O))O
Functional groups:
CC=O, CO
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic oxygen compounds
ClassyFire Class:
Organooxygen compounds
ClassyFire Subclass:
Carbohydrates and carbohydrate conjugates
NP Classifier Biosynthetic pathway:
Carbohydrates
NP Classifier Superclass:
Saccharides
NP Classifier Class:
Monosaccharides
NP-Likeness score:
2.155
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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