Glycoside
GD004763
Name:
NoneFormula:
C12H14O6N2SSmiles:
Cc1csc2c(=O)n(C3OC(CO)C(O)C3O)c(=O)[nH]c12Aglycone:
Cc1csc2c(=O)[nH]c(=O)[nH]c12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 314.32 | Num_heavy_atoms: | 21 |
| TPSA: | 124.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD04117
Formula: C7H6O2N2S
Smiles:
Cc1csc2c(=O)[nH]c(=O)[nH]c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 0 |
| MolWt: | 182.2 | Num_heavy_atoms: | 12 |
| TPSA: | 65.72 | NumAromaticRings: | 2 |
