Glycoside
GD090828
Name:
NoneFormula:
C21H31O8NSmiles:
COc1ccc(C2(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)CCOCC2)cc1Aglycone:
COc1ccc(C2(C(=O)NCCO)CCOCC2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 7 |
| MolWt: | 425.48 | Num_heavy_atoms: | 30 |
| TPSA: | 126.71 | NumAromaticRings: | 1 |
Unique Aglycone
AD39541
Formula: C15H21O4N
Smiles:
COc1ccc(C2(C(=O)NCCO)CCOCC2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 279.34 | Num_heavy_atoms: | 20 |
| TPSA: | 67.79 | NumAromaticRings: | 1 |
