Glycoside
GD102487
Name:
NoneFormula:
C22H25O6N3SSmiles:
O=C(CCn1ncc2ccccc21)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
O=C(CCn1ncc2ccccc21)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 459.52 | Num_heavy_atoms: | 32 |
| TPSA: | 137.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD43379
Formula: C16H15ON3S
Smiles:
O=C(CCn1ncc2ccccc21)Nc1ccc(S)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 297.38 | Num_heavy_atoms: | 21 |
| TPSA: | 46.92 | NumAromaticRings: | 3 |
