Glycoside
...
GD006287

Name:
None

Formula:
C22H27O11N5S

Smiles:
CC(=O)OCC1OC(Nc2nc(O)n(C)c(=O)c2-c2csc(N)n2)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:
COC(C)=O.Cn1c(O)nc(N)c(-c2csc(N)n2)c1=O

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

Other Identifiers

Properties
HBA: 16 RingCount: 3
HBD: 4 FractionCSP3: 0.5
AlogP: -0.31 Num_rotatable_bonds: 8
MolWt: 569.55 Num_heavy_atoms: 39
TPSA: 220.49 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
AD05217
Formula: C8H9O2N5S

Smiles:
Cn1c(O)nc(N)c(-c2csc(N)n2)c1=O
HBA: 7 RingCount: 2
HBD: 5 FractionCSP3: 0.12
AlogP: -0.23 Num_rotatable_bonds: 1
MolWt: 239.26 Num_heavy_atoms: 16
TPSA: 120.05 NumAromaticRings: 2

Sugarmoiety
SD00012

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