Glycoside
...
GD033766

Name:
None

Formula:
C56H61O16N5

Smiles:
CN(C(=O)c1ccccc1)[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](NC(=O)c3ccccc3)[C@H](O)[C@H]2O)O[C@@H]2C[C@H](NC(=O)c3ccccc3)[C@H](O[C@@H]3[C@H](NC(=O)c4ccccc4)C[C@H](NC(=O)c4ccccc4)[C@H](O)[C@H]3O)O[C@H]2[C@H]1O

Aglycone:
CN(C(=O)c1ccccc1)C1C(O)OC2CC(NC(=O)c3ccccc3)C(OC3C(NC(=O)c4ccccc4)CC(NC(=O)c4ccccc4)C(O)C3O)OC2C1O.NC(=O)c1ccccc1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 21 RingCount: 9
HBD: 10 FractionCSP3: 0.38
AlogP: 0.49 Num_rotatable_bonds: 15
MolWt: 1060.12 Num_heavy_atoms: 77
TPSA: 304.24 NumAromaticRings: 5

Unique Aglycone
AD01413
Formula: C7H7ON

Smiles:
NC(=O)c1ccccc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.0
AlogP: 0.79 Num_rotatable_bonds: 1
MolWt: 121.14 Num_heavy_atoms: 9
TPSA: 43.09 NumAromaticRings: 1
AD21529
Formula: C43H46O11N4

Smiles:
CN(C(=O)c1ccccc1)C1C(O)OC2CC(NC(=O)c3ccccc3)C(OC3C(NC(=O)c4ccccc4)CC(NC(=O)c4ccccc4)C(O)C3O)OC2C1O
HBA: 15 RingCount: 7
HBD: 7 FractionCSP3: 0.35
AlogP: 1.23 Num_rotatable_bonds: 10
MolWt: 794.86 Num_heavy_atoms: 58
TPSA: 216.22 NumAromaticRings: 4

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O