Glycoside
...
GD095885

Name:
None

Formula:
C19H22O9N4S

Smiles:
CSc1nc2c(nc(C)c(=O)n2[C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(=O)[nH]1

Aglycone:
CSc1nc2[nH]c(=O)c(C)nc2c(=O)[nH]1

Sugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 13 RingCount: 3
HBD: 1 FractionCSP3: 0.53
AlogP: -0.17 Num_rotatable_bonds: 5
MolWt: 482.47 Num_heavy_atoms: 33
TPSA: 168.77 NumAromaticRings: 2

Unique Aglycone
AD14807
Formula: C8H8O2N4S

Smiles:
CSc1nc2[nH]c(=O)c(C)nc2c(=O)[nH]1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.25
AlogP: 0.04 Num_rotatable_bonds: 1
MolWt: 224.25 Num_heavy_atoms: 15
TPSA: 91.5 NumAromaticRings: 2

Sugarmoiety
SD00194

CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O