Glycoside
GD057731
Name:
NoneFormula:
C13H18O6N3ClSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2c[nH]nc2Cl)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1c[nH]nc1ClSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.36 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.74 | Num_heavy_atoms: | 22 |
| TPSA: | 136.93 | NumAromaticRings: | 1 |
Unique Aglycone
AD28970
Formula: C7H8O2N3Cl
Smiles:
O=C(NCCO)c1c[nH]nc1Cl| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 189.6 | Num_heavy_atoms: | 12 |
| TPSA: | 78.01 | NumAromaticRings: | 1 |
