Glycoside
...
GD017323

Name:
None

Formula:
C27H35O11N5

Smiles:
O=C1CCN([C@@H]2O[C@H](CNC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)C[C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)C(=O)N1

Aglycone:
CNC(=O)C(Cc1c[nH]c2ccccc12)NC(C)=O.O=C1CCNC(=O)N1

Sugarmoiety:
OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 5
HBD: 9 FractionCSP3: 0.56
AlogP: -3.43 Num_rotatable_bonds: 10
MolWt: 605.6 Num_heavy_atoms: 43
TPSA: 243.01 NumAromaticRings: 2

Unique Aglycone
AD01822
Formula: C4H6O2N2

Smiles:
O=C1CCNC(=O)N1
HBA: 4 RingCount: 1
HBD: 2 FractionCSP3: 0.5
AlogP: -0.78 Num_rotatable_bonds: 0
MolWt: 114.1 Num_heavy_atoms: 8
TPSA: 58.2 NumAromaticRings: 0
AD05837
Formula: C14H17O2N3

Smiles:
CNC(=O)C(Cc1c[nH]c2ccccc12)NC(C)=O
HBA: 5 RingCount: 2
HBD: 3 FractionCSP3: 0.29
AlogP: 0.96 Num_rotatable_bonds: 4
MolWt: 259.31 Num_heavy_atoms: 19
TPSA: 73.99 NumAromaticRings: 2

Sugarmoiety
SD00153

OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1O