Glycoside
GD066565
Name:
NoneFormula:
C13H18O8N2SSmiles:
CCOC(=O)c1c(C)nsc1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CCOC(=O)c1c(C)nsc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.79 | Num_rotatable_bonds: | 8 |
| MolWt: | 362.36 | Num_heavy_atoms: | 24 |
| TPSA: | 166.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD31832
Formula: C7H10O2N2S
Smiles:
CCOC(=O)c1c(C)nsc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.24 | Num_heavy_atoms: | 12 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
