Glycoside
GD066047
Name:
NoneFormula:
C14H19O6N3SSmiles:
CSc1ncc2c(n1)CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC2Aglycone:
CSc1ncc2c(n1)CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 357.39 | Num_heavy_atoms: | 24 |
| TPSA: | 144.08 | NumAromaticRings: | 1 |
Unique Aglycone
AD31723
Formula: C8H11N3S
Smiles:
CSc1ncc2c(n1)CNCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 1 |
| MolWt: | 181.26 | Num_heavy_atoms: | 12 |
| TPSA: | 37.81 | NumAromaticRings: | 1 |
