Glycoside
...
GD012011

Name:
None

Formula:
C26H42O10N7P

Smiles:
COC(=O)[C@@H]1CCCN1P(=O)(N[C@H](C)C(=O)OCC(C)(C)C)OC[C@@H]1O[C@H](n2cnc3c(OC)nc(N)nc32)[C@@](C)(O)[C@H]1O

Aglycone:
COC(=O)C1CCCN1P(=O)(NC(C)C(=O)OCC(C)(C)C)OC.COc1nc(N)nc2c1N=C[N]2

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

Other Identifiers

Properties
HBA: 17 RingCount: 4
HBD: 5 FractionCSP3: 0.73
AlogP: 0.76 Num_rotatable_bonds: 11
MolWt: 643.64 Num_heavy_atoms: 44
TPSA: 222.71 NumAromaticRings: 2

Unique Aglycone
AD01261
Formula: C6H6ON5

Smiles:
COc1nc(N)nc2c1N=C[N]2
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.17
AlogP: -0.02 Num_rotatable_bonds: 1
MolWt: 164.15 Num_heavy_atoms: 12
TPSA: 87.49 NumAromaticRings: 1
AD09087
Formula: C15H29O6N2P

Smiles:
COC(=O)C1CCCN1P(=O)(NC(C)C(=O)OCC(C)(C)C)OC
HBA: 8 RingCount: 1
HBD: 1 FractionCSP3: 0.87
AlogP: 1.95 Num_rotatable_bonds: 7
MolWt: 364.38 Num_heavy_atoms: 24
TPSA: 94.17 NumAromaticRings: 0

Sugarmoiety
SD00027

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