Glycoside
GD099012
Name:
NoneFormula:
C23H34O9NSmiles:
COC(=O)[C@H]1C[C@@H]([NH2+]CCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)C[C@H]1C(=O)OCc1ccccc1Aglycone:
COC(=O)C1CC([NH2+]CCO)CC1C(=O)OCc1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 9 |
| MolWt: | 468.52 | Num_heavy_atoms: | 33 |
| TPSA: | 148.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD42147
Formula: C17H24O5N
Smiles:
COC(=O)C1CC([NH2+]CCO)CC1C(=O)OCc1ccccc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 7 |
| MolWt: | 322.38 | Num_heavy_atoms: | 23 |
| TPSA: | 89.44 | NumAromaticRings: | 1 |
