Glycoside
GD014899
Name:
NoneFormula:
C12H17O12NP2Smiles:
O=[N+]([O-])c1ccc(OP(=O)(O)OCC2OC(CP(=O)(O)O)C(O)C2O)cc1Aglycone:
COP(=O)(O)Oc1ccc([N+](=O)[O-])cc1.CP(=O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 429.21 | Num_heavy_atoms: | 27 |
| TPSA: | 206.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD00991
Formula: CH5O3P
Smiles:
CP(=O)(O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 96.02 | Num_heavy_atoms: | 5 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
AD10910
Formula: C7H8O6NP
Smiles:
COP(=O)(O)Oc1ccc([N+](=O)[O-])cc1| HBA: | 7 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 233.12 | Num_heavy_atoms: | 15 |
| TPSA: | 98.9 | NumAromaticRings: | 1 |
