Glycoside
GD106277
Name:
NoneFormula:
C22H32O10N2SSmiles:
CC(C)(C)OC(=O)N[C@@H](CSCNC(=O)c1ccccc1)C(=O)OC[C@@H]1O[C@@H](O)[C@@H](O)[C@H](O)[C@H]1OAglycone:
COC(=O)C(CSCNC(=O)c1ccccc1)NC(=O)OC(C)(C)CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.59 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 9 |
| MolWt: | 516.57 | Num_heavy_atoms: | 35 |
| TPSA: | 183.88 | NumAromaticRings: | 1 |
Unique Aglycone
AD44141
Formula: C17H24O5N2S
Smiles:
COC(=O)C(CSCNC(=O)c1ccccc1)NC(=O)OC(C)(C)C| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 7 |
| MolWt: | 368.46 | Num_heavy_atoms: | 25 |
| TPSA: | 93.73 | NumAromaticRings: | 1 |
