Glycoside
GD053130
Name:
NoneFormula:
C13H23O5N3SSmiles:
CC(C)CS[C@H]([C@H](O)[C@H](O)[C@H](O)CO)n1ccc(N)nc1=OAglycone:
CC(C)CSCn1ccc(N)nc1=OSugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.69 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 8 |
| MolWt: | 333.41 | Num_heavy_atoms: | 22 |
| TPSA: | 141.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD27235
Formula: C9H15ON3S
Smiles:
CC(C)CSCn1ccc(N)nc1=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.56 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 213.31 | Num_heavy_atoms: | 14 |
| TPSA: | 60.91 | NumAromaticRings: | 1 |
