IMPPAT: Indian Medicinal Plants, Phytochemistry And Therapeutics
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IMPPAT Phytochemical information:
2,3-di-O-methyl-l-rhamnose
Summary
Physicochemical
Drug-likeness
ADMET
Descriptors
Summary
IMPPAT Phytochemical identifier:
IMPHY014556
Phytochemical name:
2,3-di-O-methyl-l-rhamnose
Synonymous chemical names:
2,3-di-o-methyl-l-rhamnose
External chemical identifiers:
CID:101432348
Chemical structure information
SMILES:
CO[C@H]([C@H]([C@@H](O)C)O)[C@H](C=O)OC
InChI:
InChI=1S/C8H16O5/c1-5(10)7(11)8(13-3)6(4-9)12-2/h4-8,10-11H,1-3H3/t5-,6-,7-,8-/m0/s1
InChIKey:
QGQQTJFIYNGSEU-XAMCCFCMSA-N
DeepSMILES:
CO[C@H][C@H][C@@H]O)C))O))[C@H]C=O))OC
Functional groups:
CC=O, CO, COC
Chemical classification
ClassyFire Kingdom:
Organic compounds
ClassyFire Superclass:
Organic oxygen compounds
ClassyFire Class:
Organooxygen compounds
ClassyFire Subclass:
Carbonyl compounds
NP Classifier Biosynthetic pathway:
Carbohydrates
NP-Likeness score:
1.615
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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