Glycoside
...
GD023620

Name:
None

Formula:
C32H31O10N7

Smiles:
CC(=O)C[C@@H]1O[C@H](On2cc(CN3C(=O)C(=NNc4ccc(C#N)cc4)c4ccccc43)nn2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
N#Cc1ccc(NN=C2C(=O)N(Cc3cn(O)nn3)c3ccccc32)cc1

Sugarmoiety:
CC(=O)CC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 17 RingCount: 5
HBD: 1 FractionCSP3: 0.34
AlogP: 1.44 Num_rotatable_bonds: 11
MolWt: 673.64 Num_heavy_atoms: 49
TPSA: 213.63 NumAromaticRings: 3

Unique Aglycone
AD08777
Formula: C18H13O2N7

Smiles:
N#Cc1ccc(NN=C2C(=O)N(Cc3cn(O)nn3)c3ccccc32)cc1
HBA: 9 RingCount: 4
HBD: 2 FractionCSP3: 0.06
AlogP: 1.75 Num_rotatable_bonds: 4
MolWt: 359.35 Num_heavy_atoms: 27
TPSA: 119.43 NumAromaticRings: 3

Sugarmoiety
SD00261

CC(=O)CC1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O