Glycoside
GD074785
Name:
NoneFormula:
C15H21O7N3SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2ccc3n[nH]cc3c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=S(=O)(NCCO)c1ccc2n[nH]cc2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 387.41 | Num_heavy_atoms: | 26 |
| TPSA: | 154.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD34578
Formula: C9H11O3N3S
Smiles:
O=S(=O)(NCCO)c1ccc2n[nH]cc2c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 241.27 | Num_heavy_atoms: | 16 |
| TPSA: | 95.08 | NumAromaticRings: | 2 |
