Glycoside
GD023352
Name:
NoneFormula:
C26H27O11N3Cl2Smiles:
CN(C(=O)Oc1ccc(N(CCCl)CCCl)cc1)c1cc([N+](=O)[O-])ccc1O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CN(C(=O)Oc1ccc(N(CCCl)CCCl)cc1)c1cc([N+](=O)[O-])ccc1OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 11 |
| MolWt: | 604.4 | Num_heavy_atoms: | 40 |
| TPSA: | 192.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD15717
Formula: C20H19O5N3Cl2
Smiles:
CN(C(=O)Oc1ccc(N(CCCl)CCCl)cc1)c1cc([N+](=O)[O-])ccc1O| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.28 |
| AlogP: | 4.22 | Num_rotatable_bonds: | 8 |
| MolWt: | 428.27 | Num_heavy_atoms: | 28 |
| TPSA: | 96.15 | NumAromaticRings: | 2 |
