Glycoside
...
GD014435

Name:
None

Formula:
C33H35O9N6F2P

Smiles:
CCOc1nc(N)nc2c1ncn2[C@@H]1O[C@H](COP(=O)(N[C@H](C)C(=O)OCc2ccc(F)cc2F)Oc2cccc3ccccc23)[C@H](O)[C@]1(C)O

Aglycone:
CCOc1nc(N)nc2c1N=C[N]2.COP(=O)(NC(C)C(=O)OCc1ccc(F)cc1F)Oc1cccc2ccccc12

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

Other Identifiers

Properties
HBA: 15 RingCount: 6
HBD: 5 FractionCSP3: 0.33
AlogP: 4.17 Num_rotatable_bonds: 13
MolWt: 728.65 Num_heavy_atoms: 51
TPSA: 202.4 NumAromaticRings: 5

Unique Aglycone
AD02872
Formula: C7H8ON5

Smiles:
CCOc1nc(N)nc2c1N=C[N]2
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.29
AlogP: 0.37 Num_rotatable_bonds: 2
MolWt: 178.18 Num_heavy_atoms: 13
TPSA: 87.49 NumAromaticRings: 1
AD10613
Formula: C21H20O5NF2P

Smiles:
COP(=O)(NC(C)C(=O)OCc1ccc(F)cc1F)Oc1cccc2ccccc12
HBA: 6 RingCount: 3
HBD: 1 FractionCSP3: 0.19
AlogP: 4.97 Num_rotatable_bonds: 8
MolWt: 435.36 Num_heavy_atoms: 30
TPSA: 73.86 NumAromaticRings: 3

Sugarmoiety
SD00027

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