Glycoside
GD105796
Name:
NoneFormula:
C10H19O15N4P3Smiles:
O=c1[nH]cnc2c1ncn2[C@H]1O[C@@H]([C@@H](O[PH](O)(O)O)O[PH](O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1OAglycone:
O=P(O)(O)O[PH](O)(O)OCO[PH](O)(O)O.O=c1[nH]cnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.5 |
| AlogP: | -4.01 | Num_rotatable_bonds: | 8 |
| MolWt: | 528.2 | Num_heavy_atoms: | 32 |
| TPSA: | 299.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD01144
Formula: C5H3ON4
Smiles:
O=c1[nH]cnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.11 | Num_heavy_atoms: | 10 |
| TPSA: | 72.21 | NumAromaticRings: | 1 |
AD44076
Formula: CH11O11P3
Smiles:
O=P(O)(O)O[PH](O)(O)OCO[PH](O)(O)O| HBA: | 11 | RingCount: | 0 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 292.01 | Num_heavy_atoms: | 15 |
| TPSA: | 186.37 | NumAromaticRings: | 0 |
