Glycoside
GD021279
Name:
NoneFormula:
C12H15O9N3Smiles:
COC(=O)NC(=O)c1cn(C2OC(CO)C(O)C2O)c(=O)[nH]c1=OAglycone:
COC(=O)NC(=O)c1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -3.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 345.26 | Num_heavy_atoms: | 24 |
| TPSA: | 180.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD14575
Formula: C7H7O5N3
Smiles:
COC(=O)NC(=O)c1c[nH]c(=O)[nH]c1=O| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 1 |
| MolWt: | 213.15 | Num_heavy_atoms: | 15 |
| TPSA: | 121.12 | NumAromaticRings: | 1 |
