Glycoside
...
GD016422

Name:
None

Formula:
C31H33O9N6P

Smiles:
C[C@H](NP(=O)(OC[C@@H]1O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@](C)(O)[C@H]1O)Oc1cccc2ccccc12)C(=O)OCc1ccccc1

Aglycone:
COP(=O)(NC(C)C(=O)OCc1ccccc1)Oc1cccc2ccccc12.Nc1nc2c(c(=O)[nH]1)N=C[N]2

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

Other Identifiers

Properties
HBA: 15 RingCount: 6
HBD: 6 FractionCSP3: 0.29
AlogP: 2.79 Num_rotatable_bonds: 11
MolWt: 664.61 Num_heavy_atoms: 47
TPSA: 213.14 NumAromaticRings: 5

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
AD01728
Formula: C21H22O5NP

Smiles:
COP(=O)(NC(C)C(=O)OCc1ccccc1)Oc1cccc2ccccc12
HBA: 6 RingCount: 3
HBD: 1 FractionCSP3: 0.19
AlogP: 4.69 Num_rotatable_bonds: 8
MolWt: 399.38 Num_heavy_atoms: 28
TPSA: 73.86 NumAromaticRings: 3

Sugarmoiety
SD00027

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