Glycoside
...
GD005724

Name:
None

Formula:
C27H36O9N7P

Smiles:
CC(C)O[C@@H]1[C@@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H](COP(=O)(O)NC(Cc2c[nH]c3ccccc23)C(=O)O)[C@H]1OC(C)C

Aglycone:
COP(=O)(O)NC(Cc1c[nH]c2ccccc12)C(=O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:
CC(C)OC1C(O)OC(O)C1OC(C)C

Other Identifiers

Properties
HBA: 16 RingCount: 5
HBD: 7 FractionCSP3: 0.48
AlogP: 2.07 Num_rotatable_bonds: 13
MolWt: 633.6 Num_heavy_atoms: 44
TPSA: 228.93 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
AD00346
Formula: C12H15O5N2P

Smiles:
COP(=O)(O)NC(Cc1c[nH]c2ccccc12)C(=O)O
HBA: 7 RingCount: 2
HBD: 4 FractionCSP3: 0.25
AlogP: 1.5 Num_rotatable_bonds: 6
MolWt: 298.24 Num_heavy_atoms: 20
TPSA: 111.65 NumAromaticRings: 2

Sugarmoiety
SD00754

CC(C)OC1C(O)OC(O)C1OC(C)C