Glycoside
GD064341
Name:
NoneFormula:
C15H21O6N3SSmiles:
O=C([C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)N1CC2(CN(Cc3cncs3)C2)C1Aglycone:
O=CN1CC2(C1)CN(Cc1cncs1)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | -2.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 371.42 | Num_heavy_atoms: | 25 |
| TPSA: | 126.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD30963
Formula: C10H13ON3S
Smiles:
O=CN1CC2(C1)CN(Cc1cncs1)C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.6 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 223.3 | Num_heavy_atoms: | 15 |
| TPSA: | 36.44 | NumAromaticRings: | 1 |
