Glycoside
GD032984
Name:
NoneFormula:
C10H14O9N4Smiles:
O=c1[nH]c(=O)n2c(c1[N+](=O)[O-])NC(C(O)C(O)C(O)CO)C2OAglycone:
O=c1[nH]c(=O)n2c(c1[N+](=O)[O-])NCC2OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.6 |
| AlogP: | -4.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 334.24 | Num_heavy_atoms: | 23 |
| TPSA: | 211.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD21087
Formula: C6H6O5N4
Smiles:
O=c1[nH]c(=O)n2c(c1[N+](=O)[O-])NCC2O| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 214.14 | Num_heavy_atoms: | 15 |
| TPSA: | 130.26 | NumAromaticRings: | 1 |
