Glycoside
GD074116
Name:
NoneFormula:
C16H23O8NSSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccc3c(c2)CCO3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NCCO)c1ccc2c(c1)CCO2Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 389.43 | Num_heavy_atoms: | 26 |
| TPSA: | 134.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD34253
Formula: C10H13O4NS
Smiles:
O=S(=O)(NCCO)c1ccc2c(c1)CCO2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 243.28 | Num_heavy_atoms: | 16 |
| TPSA: | 75.63 | NumAromaticRings: | 1 |
