Glycoside
GD079113
Name:
NoneFormula:
C14H23O7N6PSmiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)N2CCOCC2)[C@@H](O)[C@H]1OAglycone:
CO[PH](O)(O)N1CCOCC1.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -2.23 | Num_rotatable_bonds: | 5 |
| MolWt: | 418.35 | Num_heavy_atoms: | 28 |
| TPSA: | 181.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD33531
Formula: C5H14O4NP
Smiles:
CO[PH](O)(O)N1CCOCC1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 183.14 | Num_heavy_atoms: | 11 |
| TPSA: | 62.16 | NumAromaticRings: | 0 |
