Glycoside
...
GD020051

Name:
None

Formula:
C18H24O8N8S

Smiles:
CC(=O)O[C@@H]1[C@@H](NC(=S)NNC(=O)Cn2cnc3c(N)ncnc32)O[C@@H](CO)[C@@H](O)[C@H]1OC(C)=O

Aglycone:
NC(=S)NNC(=O)Cn1cnc2c(N)ncnc21

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

Other Identifiers

Properties
HBA: 16 RingCount: 3
HBD: 7 FractionCSP3: 0.5
AlogP: -3.15 Num_rotatable_bonds: 6
MolWt: 512.51 Num_heavy_atoms: 35
TPSA: 225.07 NumAromaticRings: 2

Unique Aglycone
AD12647
Formula: C8H10ON8S

Smiles:
NC(=S)NNC(=O)Cn1cnc2c(N)ncnc21
HBA: 9 RingCount: 2
HBD: 6 FractionCSP3: 0.12
AlogP: -1.73 Num_rotatable_bonds: 2
MolWt: 266.29 Num_heavy_atoms: 18
TPSA: 136.77 NumAromaticRings: 2

Sugarmoiety
SD00614

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