Glycoside
GD049541
Name:
NoneFormula:
C13H20O7N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)Cc2ccon2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(Cc1ccon1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 6 |
| MolWt: | 316.31 | Num_heavy_atoms: | 22 |
| TPSA: | 134.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD26231
Formula: C7H10O3N2
Smiles:
O=C(Cc1ccon1)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 170.17 | Num_heavy_atoms: | 12 |
| TPSA: | 75.36 | NumAromaticRings: | 1 |
