Glycoside
GD018101
Name:
NoneFormula:
C26H35O12N3Cl2Smiles:
O=NN(CCCl)C(=O)N(Cc1ccc(Cl)cc1)C1OC(CO)C(COCC2OC(CO)C(O)C(O)C2O)C(O)C1OAglycone:
COCC1C(CO)OC(N(Cc2ccc(Cl)cc2)C(=O)N(CCCl)N=O)C(O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.71 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 12 |
| MolWt: | 628.46 | Num_heavy_atoms: | 41 |
| TPSA: | 222.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD12826
Formula: C20H25O7N3Cl2
Smiles:
COCC1C(CO)OC(N(Cc2ccc(Cl)cc2)C(=O)N(CCCl)N=O)C(O)C1O| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.61 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 466.32 | Num_heavy_atoms: | 30 |
| TPSA: | 132.13 | NumAromaticRings: | 1 |
