Glycoside
GD122376
Name:
NoneFormula:
C13H24O11N4P2Smiles:
CN(C)CCOP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(=N)nc2O)C(O)C1OAglycone:
COP(=O)(O)OP(=O)(O)OCCN(C)C.N=C1C=C[N]C(O)=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 10 |
| MolWt: | 474.3 | Num_heavy_atoms: | 30 |
| TPSA: | 217.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD45484
Formula: C4H4ON3
Smiles:
N=C1C=C[N]C(O)=N1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 0 |
| MolWt: | 110.1 | Num_heavy_atoms: | 8 |
| TPSA: | 70.54 | NumAromaticRings: | 0 |
AD49305
Formula: C5H15O7NP2
Smiles:
COP(=O)(O)OP(=O)(O)OCCN(C)C| HBA: | 8 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 7 |
| MolWt: | 263.12 | Num_heavy_atoms: | 15 |
| TPSA: | 105.53 | NumAromaticRings: | 0 |
