Glycoside
GD033193
Name:
NoneFormula:
C21H24O11N2Smiles:
O=C(CN(C(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OAglycone:
NC(=O)CN(C(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.33 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 480.43 | Num_heavy_atoms: | 34 |
| TPSA: | 220.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD21208
Formula: C15H14O6N2
Smiles:
NC(=O)CN(C(=O)c1cc(O)c(O)c(O)c1)c1ccc(O)cc1| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.29 | Num_heavy_atoms: | 23 |
| TPSA: | 144.32 | NumAromaticRings: | 2 |
