Glycoside
GD034119
Name:
NoneFormula:
C12H12O5N3ClSmiles:
O=c1[nH]cnc2c1c(Cl)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1[nH]cnc2c1C(Cl)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 301.69 | Num_heavy_atoms: | 20 |
| TPSA: | 120.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD21721
Formula: C7H3ON3Cl
Smiles:
O=c1[nH]cnc2c1C(Cl)=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.56 | Num_heavy_atoms: | 11 |
| TPSA: | 59.85 | NumAromaticRings: | 1 |
