Glycoside
GD095312
Name:
NoneFormula:
C22H32O9N2Smiles:
COC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
COC(=O)C(Cc1ccccc1)NC(=O)CCC(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 11 |
| MolWt: | 468.5 | Num_heavy_atoms: | 33 |
| TPSA: | 163.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD40679
Formula: C16H22O5N2
Smiles:
COC(=O)C(Cc1ccccc1)NC(=O)CCC(=O)NCCO| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 9 |
| MolWt: | 322.36 | Num_heavy_atoms: | 23 |
| TPSA: | 104.73 | NumAromaticRings: | 1 |
