Glycoside
...
GD103684

Name:
None

Formula:
C20H26O9N4S

Smiles:
CSc1nc(N[C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)[nH]1

Aglycone:
CSc1nc(N)c(N=C(C)C(C)=O)c(=O)[nH]1

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

Other Identifiers

Properties
HBA: 13 RingCount: 2
HBD: 2 FractionCSP3: 0.55
AlogP: 0.74 Num_rotatable_bonds: 8
MolWt: 498.51 Num_heavy_atoms: 34
TPSA: 175.34 NumAromaticRings: 1

Unique Aglycone
AD04466
Formula: C9H12O2N4S

Smiles:
CSc1nc(N)c(N=C(C)C(C)=O)c(=O)[nH]1
HBA: 6 RingCount: 1
HBD: 3 FractionCSP3: 0.33
AlogP: 0.76 Num_rotatable_bonds: 3
MolWt: 240.29 Num_heavy_atoms: 16
TPSA: 101.2 NumAromaticRings: 1

Sugarmoiety
SD00194

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