Glycoside
...
GD096503

Name:
None

Formula:
C15H24O9N5PS

Smiles:
O=S(=O)(CC1CCC1)Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]1O

Aglycone:
CO[PH](O)(O)O.O=S(=O)(CC1CCC1)Nc1ncnc2c1N=C[N]2

Sugarmoiety:
OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 14 RingCount: 4
HBD: 6 FractionCSP3: 0.67
AlogP: -1.61 Num_rotatable_bonds: 8
MolWt: 481.42 Num_heavy_atoms: 31
TPSA: 209.38 NumAromaticRings: 2

Unique Aglycone
AD01852
Formula: CH7O4P

Smiles:
CO[PH](O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -0.98 Num_rotatable_bonds: 1
MolWt: 114.04 Num_heavy_atoms: 6
TPSA: 69.92 NumAromaticRings: 0
AD33783
Formula: C10H12O2N5S

Smiles:
O=S(=O)(CC1CCC1)Nc1ncnc2c1N=C[N]2
HBA: 7 RingCount: 3
HBD: 1 FractionCSP3: 0.5
AlogP: 0.93 Num_rotatable_bonds: 4
MolWt: 266.31 Num_heavy_atoms: 18
TPSA: 98.41 NumAromaticRings: 1

Sugarmoiety
SD00018

OC1OC(O)C(O)C1O