Glycoside
GD103343
Name:
NoneFormula:
C22H30O8NClSSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)C2(Cc3ccccc3Cl)CCS(=O)(=O)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1(Cc2ccccc2Cl)CCS(=O)(=O)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 7 |
| MolWt: | 491.99 | Num_heavy_atoms: | 32 |
| TPSA: | 142.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD43740
Formula: C16H20O4NClS
Smiles:
O=C(NCCO)C1(Cc2ccccc2Cl)CCS(=O)(=O)CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 345.85 | Num_heavy_atoms: | 22 |
| TPSA: | 83.47 | NumAromaticRings: | 1 |
