Glycoside
GD022681
Name:
NoneFormula:
C27H41O8N3Smiles:
CC(C)c1[nH]nc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Cc1ccc(CCCC(=O)NC(C)(C)CO)cc1Aglycone:
CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NC(C)(C)CO)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.63 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 12 |
| MolWt: | 535.64 | Num_heavy_atoms: | 38 |
| TPSA: | 177.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD15350
Formula: C21H31O3N3
Smiles:
CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NC(C)(C)CO)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 9 |
| MolWt: | 373.5 | Num_heavy_atoms: | 27 |
| TPSA: | 98.24 | NumAromaticRings: | 2 |
