Glycoside
GD029553
Name:
NoneFormula:
C16H25O10N3Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@H](C)[C@@H]1NC(=O)[C@H](CC(=O)O)NC1=OAglycone:
CC(O)C1NC(=O)C(CC(=O)O)NC1=OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.75 |
| AlogP: | -4.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 419.39 | Num_heavy_atoms: | 29 |
| TPSA: | 203.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD19214
Formula: C8H12O5N2
Smiles:
CC(O)C1NC(=O)C(CC(=O)O)NC1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 216.19 | Num_heavy_atoms: | 15 |
| TPSA: | 115.73 | NumAromaticRings: | 0 |
