Glycoside
...
GD010983

Name:
None

Formula:
C38H47O19N4ClS

Smiles:
CCS(=O)(=O)N(Cc1cn([C@@H]2O[C@H](COC(C)=O)[C@H](O[C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)nn1)c1ccc(Cl)cc1

Aglycone:
CCS(=O)(=O)N(CC1=C[N]N=N1)c1ccc(Cl)cc1.COC(C)=O.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 23 RingCount: 4
HBD: 0 FractionCSP3: 0.59
AlogP: 1.08 Num_rotatable_bonds: 17
MolWt: 919.31 Num_heavy_atoms: 62
TPSA: 279.88 NumAromaticRings: 2

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD06726
Formula: C12H12O2N4ClS

Smiles:
CCS(=O)(=O)N(CC1=C[N]N=N1)c1ccc(Cl)cc1
HBA: 6 RingCount: 2
HBD: 0 FractionCSP3: 0.27
AlogP: 2.32 Num_rotatable_bonds: 5
MolWt: 299.76 Num_heavy_atoms: 19
TPSA: 76.2 NumAromaticRings: 1

Sugarmoiety
SD00271

CC(=O)OC1C(O)OC(O)C(OC2OC(O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1OC(C)=O