Glycoside
GD090813
Name:
NoneFormula:
C22H32O7N2Smiles:
Cc1ccc(C(=O)N2CCC(C(=O)NCCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)CC2)cc1Aglycone:
Cc1ccc(C(=O)N2CCC(C(=O)NCCO)CC2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.51 | Num_heavy_atoms: | 31 |
| TPSA: | 128.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD39534
Formula: C16H22O3N2
Smiles:
Cc1ccc(C(=O)N2CCC(C(=O)NCCO)CC2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.36 | Num_heavy_atoms: | 21 |
| TPSA: | 69.64 | NumAromaticRings: | 1 |
