Glycoside
GD013741
Name:
NoneFormula:
C24H33O7NSSmiles:
COC1[C@H](SC2OC(CO)C(O)C(O)C2O)C=C[C@@H]2[C@@H]3Cc4ccc(O)cc4[C@@]12CCN3CAglycone:
COC1C(S)C=CC2C3Cc4ccc(O)cc4C21CCN3CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 479.6 | Num_heavy_atoms: | 33 |
| TPSA: | 122.85 | NumAromaticRings: | 1 |
Unique Aglycone
AD10208
Formula: C18H23O2NS
Smiles:
COC1C(S)C=CC2C3Cc4ccc(O)cc4C21CCN3C| HBA: | 3 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 2.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 317.45 | Num_heavy_atoms: | 22 |
| TPSA: | 32.7 | NumAromaticRings: | 1 |
