Glycoside
...
GD012433

Name:
None

Formula:
C48H52O14N7P

Smiles:
COc1nc(N)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(N[C@H](CC(=O)OCc2ccccc2)C(=O)OCc2ccccc2)N[C@H](CC(=O)OCc2ccccc2)C(=O)OCc2ccccc2)[C@H](O)[C@]1(C)O

Aglycone:
COP(=O)(NC(CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)NC(CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1.COc1nc(N)nc2c1N=C[N]2

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

Other Identifiers

Properties
HBA: 21 RingCount: 7
HBD: 6 FractionCSP3: 0.31
AlogP: 4.22 Num_rotatable_bonds: 23
MolWt: 981.95 Num_heavy_atoms: 70
TPSA: 284.1 NumAromaticRings: 6

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
AD09376
Formula: C37H39O10N2P

Smiles:
COP(=O)(NC(CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)NC(CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1
HBA: 12 RingCount: 4
HBD: 2 FractionCSP3: 0.24
AlogP: 5.41 Num_rotatable_bonds: 19
MolWt: 702.7 Num_heavy_atoms: 50
TPSA: 155.56 NumAromaticRings: 4

Sugarmoiety
SD00027

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