Glycoside
GD103163
Name:
NoneFormula:
C22H26O8N2SSmiles:
CCOC(=O)c1cnc(C)c(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)c1Aglycone:
CCOC(=O)c1cnc(C)c(C(=O)Nc2ccc(S)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 7 |
| MolWt: | 478.52 | Num_heavy_atoms: | 33 |
| TPSA: | 158.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD43642
Formula: C16H16O3N2S
Smiles:
CCOC(=O)c1cnc(C)c(C(=O)Nc2ccc(S)cc2)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 3.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.38 | Num_heavy_atoms: | 22 |
| TPSA: | 68.29 | NumAromaticRings: | 2 |
