Glycoside
...
GD017499

Name:
REMOGLIFLOZIN ETABONATE

Formula:
C26H38O9N2

Smiles:
CCOC(=O)OC[C@@H]1O[C@H](Oc2nn(C(C)C)c(C)c2Cc2ccc(OC(C)C)cc2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CCOC(=O)OC.Cc1c(Cc2ccc(OC(C)C)cc2)c(O)nn1C(C)C

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 3 FractionCSP3: 0.62
AlogP: 2.51 Num_rotatable_bonds: 10
MolWt: 522.6 Num_heavy_atoms: 37
TPSA: 141.73 NumAromaticRings: 2

Unique Aglycone
AD12477
Formula: C4H8O3

Smiles:
CCOC(=O)OC
HBA: 3 RingCount: 0
HBD: 0 FractionCSP3: 0.75
AlogP: 0.79 Num_rotatable_bonds: 1
MolWt: 104.1 Num_heavy_atoms: 7
TPSA: 35.53 NumAromaticRings: 0
AD12478
Formula: C17H24O2N2

Smiles:
Cc1c(Cc2ccc(OC(C)C)cc2)c(O)nn1C(C)C
HBA: 4 RingCount: 2
HBD: 1 FractionCSP3: 0.47
AlogP: 3.86 Num_rotatable_bonds: 5
MolWt: 288.39 Num_heavy_atoms: 21
TPSA: 47.28 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O