Glycoside
GD059659
Name:
NoneFormula:
C12H19O6N3SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)Nc2nccs2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)Nc1nccs1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 333.37 | Num_heavy_atoms: | 22 |
| TPSA: | 133.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD29532
Formula: C6H9O2N3S
Smiles:
O=C(NCCO)Nc1nccs1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 187.22 | Num_heavy_atoms: | 12 |
| TPSA: | 74.25 | NumAromaticRings: | 1 |
