Glycoside
GD019591
Name:
NoneFormula:
C15H16O5SSmiles:
O[C@@H]1[C@@H](Oc2cccc3c(S)cccc23)OC[C@@H](O)[C@H]1OAglycone:
Oc1cccc2c(S)cccc12Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 308.36 | Num_heavy_atoms: | 21 |
| TPSA: | 79.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD12994
Formula: C10H8OS
Smiles:
Oc1cccc2c(S)cccc12| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.83 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.24 | Num_heavy_atoms: | 12 |
| TPSA: | 20.23 | NumAromaticRings: | 2 |
