Glycoside
...
GD099364

Name:
None

Formula:
C21H35O8N5

Smiles:
C=CCN(Cc1cn(CCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)nn1)C(=O)OC(C)(C)C

Aglycone:
C=CCN(Cc1cn(CCO)nn1)C(=O)OC(C)(C)C

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 4 FractionCSP3: 0.71
AlogP: -0.84 Num_rotatable_bonds: 10
MolWt: 485.54 Num_heavy_atoms: 34
TPSA: 168.5 NumAromaticRings: 1

Unique Aglycone
AD40322
Formula: C13H22O3N4

Smiles:
C=CCN(Cc1cn(CCO)nn1)C(=O)OC(C)(C)C
HBA: 7 RingCount: 1
HBD: 1 FractionCSP3: 0.62
AlogP: 1.19 Num_rotatable_bonds: 6
MolWt: 282.34 Num_heavy_atoms: 20
TPSA: 80.48 NumAromaticRings: 1

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O