Glycoside
GD035768
Name:
NoneFormula:
C29H35O14NSSmiles:
Cc1ccc(S(=O)(=O)N=c2oc3ccccc3cc2CO[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1ccc(S(=O)(=O)N=c2oc3ccccc3cc2CO)cc1Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.48 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 9 |
| MolWt: | 653.66 | Num_heavy_atoms: | 45 |
| TPSA: | 238.17 | NumAromaticRings: | 3 |
Unique Aglycone
AD06265
Formula: C17H15O4NS
Smiles:
Cc1ccc(S(=O)(=O)N=c2oc3ccccc3cc2CO)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 329.38 | Num_heavy_atoms: | 23 |
| TPSA: | 79.87 | NumAromaticRings: | 3 |
