Glycoside
...
GD032876

Name:
None

Formula:
C30H37O21N15P4

Smiles:
Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(=O)(O)O[C@@H]2[C@@H](O)[C@@H](COP(=O)(O)O)O[C@H]2n2cnc3c(N)ncnc32)[C@H](O)[C@H]1OP(=O)(O)OC[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@@H]2OP(=O)(O)O[C@H]12

Aglycone:
COP(=O)(O)O.COP(=O)(O)O.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C2OP(=O)(O)OC21

Sugarmoiety:
OC1OC(O)C(O)O1.OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 36 RingCount: 10
HBD: 13 FractionCSP3: 0.5
AlogP: -2.34 Num_rotatable_bonds: 16
MolWt: 1067.61 Num_heavy_atoms: 70
TPSA: 511.05 NumAromaticRings: 6

Unique Aglycone
AD00058
Formula: C5H4N5

Smiles:
Nc1ncnc2c1N=C[N]2
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 0.0
AlogP: -0.03 Num_rotatable_bonds: 0
MolWt: 134.12 Num_heavy_atoms: 10
TPSA: 78.26 NumAromaticRings: 1
AD00079
Formula: CH5O4P

Smiles:
COP(=O)(O)O
HBA: 4 RingCount: 0
HBD: 2 FractionCSP3: 1.0
AlogP: -0.27 Num_rotatable_bonds: 1
MolWt: 112.02 Num_heavy_atoms: 6
TPSA: 66.76 NumAromaticRings: 0
AD21030
Formula: C10H13O9N5P2

Smiles:
Nc1ncnc2c1ncn2C1OC(COP(=O)(O)O)C2OP(=O)(O)OC21
HBA: 14 RingCount: 4
HBD: 5 FractionCSP3: 0.5
AlogP: -0.7 Num_rotatable_bonds: 4
MolWt: 409.19 Num_heavy_atoms: 26
TPSA: 201.37 NumAromaticRings: 2

Sugarmoiety
SD01496

OC1OC(O)C(O)O1.OCC1OC(O)C(O)C1O