Glycoside
...
GD034551

Name:
None

Formula:
C33H41O11N6P

Smiles:
CCOC(=O)CCc1ccccc1OP(=O)(OC[C@@H]1O[C@H](n2cnc3c(N)nc(N)nc32)[C@@](C)(O)[C@H]1O)Oc1ccccc1CCC(=O)OCC

Aglycone:
CCOC(=O)CCc1ccccc1OP(=O)(OC)Oc1ccccc1CCC(=O)OCC.Nc1nc(N)c2c(n1)[N]C=N2

Sugarmoiety:
CC1(O)C(O)OC(O)C1O

Other Identifiers

Properties
HBA: 17 RingCount: 5
HBD: 6 FractionCSP3: 0.42
AlogP: 3.27 Num_rotatable_bonds: 16
MolWt: 728.7 Num_heavy_atoms: 51
TPSA: 242.69 NumAromaticRings: 4

Unique Aglycone
AD01628
Formula: C5H5N6

Smiles:
Nc1nc(N)c2c(n1)[N]C=N2
HBA: 6 RingCount: 2
HBD: 4 FractionCSP3: 0.0
AlogP: -0.45 Num_rotatable_bonds: 0
MolWt: 149.14 Num_heavy_atoms: 11
TPSA: 104.28 NumAromaticRings: 1
AD21957
Formula: C23H29O8P

Smiles:
CCOC(=O)CCc1ccccc1OP(=O)(OC)Oc1ccccc1CCC(=O)OCC
HBA: 8 RingCount: 2
HBD: 0 FractionCSP3: 0.39
AlogP: 4.89 Num_rotatable_bonds: 13
MolWt: 464.45 Num_heavy_atoms: 32
TPSA: 97.36 NumAromaticRings: 2

Sugarmoiety
SD00027

CC1(O)C(O)OC(O)C1O