Glycoside
GD020766
Name:
NoneFormula:
C14H10O8S2Smiles:
O=C(OC(C(=O)O)C(OC(=O)c1cccs1)C(=O)O)c1cccs1Aglycone:
O=Cc1cccs1.O=Cc1cccs1Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 7 |
| MolWt: | 370.36 | Num_heavy_atoms: | 24 |
| TPSA: | 127.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD14284
Formula: C5H4OS
Smiles:
O=Cc1cccs1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.15 | Num_heavy_atoms: | 7 |
| TPSA: | 17.07 | NumAromaticRings: | 1 |
