Glycoside
...
GD015156

Name:
None

Formula:
C24H34O7N4

Smiles:
N[C@H]1C[C@@H](N)[C@H](O[C@@H]2O[C@H](CNC(=O)Cc3cccc4ccccc34)[C@H](O)[C@H](O)[C@H]2N)[C@@H](O)[C@H]1O

Aglycone:
CNC(=O)Cc1cccc2ccccc12.NC1CC(N)C(O)C(O)C1O

Sugarmoiety:
NC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 4
HBD: 11 FractionCSP3: 0.54
AlogP: -2.56 Num_rotatable_bonds: 6
MolWt: 490.56 Num_heavy_atoms: 35
TPSA: 206.54 NumAromaticRings: 2

Unique Aglycone
AD00009
Formula: C6H14O3N2

Smiles:
NC1CC(N)C(O)C(O)C1O
HBA: 5 RingCount: 1
HBD: 7 FractionCSP3: 1.0
AlogP: -2.87 Num_rotatable_bonds: 0
MolWt: 162.19 Num_heavy_atoms: 11
TPSA: 112.73 NumAromaticRings: 0
AD11048
Formula: C13H13ON

Smiles:
CNC(=O)Cc1cccc2ccccc12
HBA: 2 RingCount: 2
HBD: 1 FractionCSP3: 0.15
AlogP: 2.13 Num_rotatable_bonds: 2
MolWt: 199.25 Num_heavy_atoms: 15
TPSA: 29.1 NumAromaticRings: 2

Sugarmoiety
SD00266

NC1C(O)OC(O)C(O)C1O