Glycoside
GD101332
Name:
NoneFormula:
C24H37O8N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccc(N3CCN(C(=O)OC(C)(C)C)CC3)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCN(c2cccc(C(=O)NCCO)c2)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 495.57 | Num_heavy_atoms: | 35 |
| TPSA: | 141.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD42884
Formula: C18H27O4N3
Smiles:
CC(C)(C)OC(=O)N1CCN(c2cccc(C(=O)NCCO)c2)CC1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 349.43 | Num_heavy_atoms: | 25 |
| TPSA: | 82.11 | NumAromaticRings: | 1 |
