Glycoside
GD144572
Name:
NoneFormula:
C12H22O11N4P2Smiles:
CNCCOP(=O)(O)OP(=O)(O)OCC1OC(n2ccc(=N)nc2O)C(O)C1OAglycone:
CNCCOP(=O)(O)OP(=O)(O)OC.N=C1C=C[N]C(O)=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.67 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 10 |
| MolWt: | 460.27 | Num_heavy_atoms: | 29 |
| TPSA: | 225.91 | 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 |
AD58090
Formula: C4H13O7NP2
Smiles:
CNCCOP(=O)(O)OP(=O)(O)OC| HBA: | 8 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 7 |
| MolWt: | 249.1 | Num_heavy_atoms: | 14 |
| TPSA: | 114.32 | NumAromaticRings: | 0 |
