Glycoside
GD101899
Name:
NoneFormula:
C22H24O7N4SSmiles:
O=C(CCc1nc(-c2ccccn2)no1)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1Aglycone:
O=C(CCc1nc(-c2ccccn2)no1)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 8 |
| MolWt: | 488.52 | Num_heavy_atoms: | 34 |
| TPSA: | 171.06 | NumAromaticRings: | 3 |
Unique Aglycone
AD43142
Formula: C16H14O2N4S
Smiles:
O=C(CCc1nc(-c2ccccn2)no1)Nc1ccc(S)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.38 | Num_heavy_atoms: | 23 |
| TPSA: | 80.91 | NumAromaticRings: | 3 |
