Glycoside
...
GD019370

Name:
None

Formula:
C28H35O9N6P

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

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

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

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 6 FractionCSP3: 0.43
AlogP: 2.25 Num_rotatable_bonds: 11
MolWt: 630.6 Num_heavy_atoms: 44
TPSA: 213.14 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
AD13531
Formula: C18H24O5NP

Smiles:
COP(=O)(NC(C)C(=O)OCC(C)C)Oc1cccc2ccccc12
HBA: 6 RingCount: 2
HBD: 1 FractionCSP3: 0.39
AlogP: 4.15 Num_rotatable_bonds: 8
MolWt: 365.37 Num_heavy_atoms: 25
TPSA: 73.86 NumAromaticRings: 2

Sugarmoiety
SD00027

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