Glycoside
GD012965
Name:
NoneFormula:
C9H14O5N2SSmiles:
OC[C@H](O)[C@@H]1O[C@H](n2cc[nH]c2=S)[C@H](O)[C@H]1OAglycone:
S=c1[nH]cc[nH]1Sugarmoiety:
OCC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 262.29 | Num_heavy_atoms: | 17 |
| TPSA: | 110.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD09732
Formula: C3H4N2S
Smiles:
S=c1[nH]cc[nH]1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 100.15 | Num_heavy_atoms: | 6 |
| TPSA: | 31.58 | NumAromaticRings: | 1 |
