Glycoside
...
GD003612

Name:
None

Formula:
C25H31O10N6P

Smiles:
CC(C)O[C@@H]1[C@@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H](COP(=O)([O-])NC(C(=O)[O-])C(=O)c2ccccc2)[C@H]1OC(C)C

Aglycone:
COP(=O)([O-])NC(C(=O)[O-])C(=O)c1ccccc1.Nc1nc2c(c(=O)[nH]1)N=C[N]2

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

Other Identifiers

Properties
HBA: 16 RingCount: 4
HBD: 4 FractionCSP3: 0.48
AlogP: -0.74 Num_rotatable_bonds: 13
MolWt: 606.53 Num_heavy_atoms: 42
TPSA: 235.87 NumAromaticRings: 3

Unique Aglycone
AD00207
Formula: C5H4ON5

Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.74 Num_rotatable_bonds: 0
MolWt: 150.12 Num_heavy_atoms: 11
TPSA: 98.23 NumAromaticRings: 1
AD03264
Formula: C10H10O6NP

Smiles:
COP(=O)([O-])NC(C(=O)[O-])C(=O)c1ccccc1
HBA: 7 RingCount: 1
HBD: 1 FractionCSP3: 0.2
AlogP: -1.31 Num_rotatable_bonds: 6
MolWt: 271.16 Num_heavy_atoms: 18
TPSA: 118.59 NumAromaticRings: 1

Sugarmoiety
SD00754

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