Glycoside
GD125870
Name:
4,5-dihydroxy-6-(4-{[(methoxymethanethioyl)amino]methyl}phenoxy)-2-methyloxan-3-yl acetateFormula:
C17H23O7NSSmiles:
COC(S)=NCc1ccc(OC2OC(C)C(OC(C)=O)C(O)C2O)cc1Aglycone:
COC(S)=NCc1ccc(O)cc1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.53 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 385.44 | Num_heavy_atoms: | 26 |
| TPSA: | 106.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD50908
Formula: C9H11O2NS
Smiles:
COC(S)=NCc1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 197.26 | Num_heavy_atoms: | 13 |
| TPSA: | 41.82 | NumAromaticRings: | 1 |
