Darunavir O-β-D-Glucuronide structure
|
Common Name | Darunavir O-β-D-Glucuronide | ||
|---|---|---|---|---|
| CAS Number | 1159613-27-0 | Molecular Weight | 723.78800 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C33H45N3O13S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | Darunavir O-β-D-Glucuronide |
|---|---|
| Synonym | More Synonyms |
| Molecular Formula | C33H45N3O13S |
|---|---|
| Molecular Weight | 723.78800 |
| Exact Mass | 723.26700 |
| PSA | 248.51000 |
| LogP | 2.15820 |
| InChIKey | QZOVHLAWBUMQFG-XXNFXRIYSA-N |
| SMILES | CC(C)CN(CC(OC1OC(C(=O)O)C(O)C(O)C1O)C(Cc1ccccc1)NC(=O)OC1COC2OCCC12)S(=O)(=O)c1ccc(N)cc1 |
| (2S,3S,4S,5R,6R)-6-[(2R,3S)-3-[[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl]oxycarbonylamino]-1-[(4-aminophenyl)sulfonyl-(2-methylpropyl)amino]-4-phenylbutan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid |