Glycoside
GD065551
Name:
NoneFormula:
C15H22O8N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CNC(=O)c2ccco2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CNC(=O)c1ccco1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 358.35 | Num_heavy_atoms: | 25 |
| TPSA: | 150.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD31523
Formula: C9H12O4N2
Smiles:
O=C(CNC(=O)c1ccco1)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 5 |
| MolWt: | 212.2 | Num_heavy_atoms: | 15 |
| TPSA: | 91.57 | NumAromaticRings: | 1 |
