Glycoside
...
GD002110

Name:
None

Formula:
C23H33O17N10P3

Smiles:
CO[C@@H]1[C@H](O)[C@H](COP(=O)([O-])OP(=O)(O)CP(=O)(O)OC[C@@H]2O[C@H](n3cnc4c(=O)[nH]c(N)nc43)[C@H](O)[C@H]2O)O[C@H]1n1c[n+](C)c2c(O)nc(N)nc21

Aglycone:
COP(=O)(O)CP(=O)(O)OP(=O)([O-])OC.C[N+]1=C[N]c2nc(N)nc(O)c21.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:
COC1C(O)OC(O)C1O.OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 27 RingCount: 6
HBD: 11 FractionCSP3: 0.57
AlogP: -4.0 Num_rotatable_bonds: 13
MolWt: 814.49 Num_heavy_atoms: 53
TPSA: 401.23 NumAromaticRings: 4

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
AD02043
Formula: C3H10O9P3

Smiles:
COP(=O)(O)CP(=O)(O)OP(=O)([O-])OC
HBA: 9 RingCount: 0
HBD: 2 FractionCSP3: 1.0
AlogP: 0.09 Num_rotatable_bonds: 6
MolWt: 283.03 Num_heavy_atoms: 15
TPSA: 142.42 NumAromaticRings: 0
AD02044
Formula: C6H7ON5

Smiles:
C[N+]1=C[N]c2nc(N)nc(O)c21
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.17
AlogP: -0.68 Num_rotatable_bonds: 0
MolWt: 165.16 Num_heavy_atoms: 12
TPSA: 89.14 NumAromaticRings: 1

Sugarmoiety
SD00513

COC1C(O)OC(O)C1O.OC1OC(O)C(O)C1O