Glycoside
GD078459
Name:
NoneFormula:
C19H26O6NClSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)CCCc2ccc(Cl)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CCCc1ccc(Cl)cc1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.61 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 8 |
| MolWt: | 387.86 | Num_heavy_atoms: | 26 |
| TPSA: | 108.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD36030
Formula: C13H16O2NCl
Smiles:
O=C(CCCc1ccc(Cl)cc1)NCCO| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 6 |
| MolWt: | 241.72 | Num_heavy_atoms: | 16 |
| TPSA: | 49.33 | NumAromaticRings: | 1 |
