Glycoside
GD096481
Name:
NoneFormula:
C19H23O8N6PSmiles:
CN1Cc2c(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]3O)cccc2C1=OAglycone:
CN1Cc2c(Nc3ncnc4c3N=C[N]4)cccc2C1=O.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.4 | Num_heavy_atoms: | 34 |
| TPSA: | 195.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD41024
Formula: C14H11ON6
Smiles:
CN1Cc2c(Nc3ncnc4c3N=C[N]4)cccc2C1=O| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 279.28 | Num_heavy_atoms: | 21 |
| TPSA: | 84.58 | NumAromaticRings: | 2 |
