| SpectraBase Compound ID | 5nC0ODyUfk9 |
|---|---|
| InChI | InChI=1S/C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t30-,31-,32-,34-/m0/s1 |
| InChIKey | KJHKTHWMRKYKJE-SUGCFTRWSA-N |
| Mol Weight | 628.8 g/mol |
| Molecular Formula | C37H48N4O5 |
| Exact Mass | 628.362471 g/mol |
Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
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| SpectraBase Spectrum ID | I4OBRuGSPWM |
|---|---|
| Name | Lopinavir |
| Source of Sample | Cayman Chemical Company |
| Catalog Number | 13854 |
| Lot Number | 0452427-20 |
| Accessory | DurasamplIR II |
| Apodization Function | Norton-Beer, medium |
| CAS Registry Number | 192725-17-0 |
| Copyright | Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C37H48N4O5 |
| IUPAC Name | N-[(1S,3S,4S)-4-[[2-(2,6-Dimethylphenoxy)acetyl]amino]-3-hydroxy-5-phenyl-1-(phenylmethyl)pentyl]tetrahydro-αS-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetamide |
| InChI | InChI=1S/C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t30-,31-,32-,34-/m0/s1 |
| InChIKey | KJHKTHWMRKYKJE-SUGCFTRWSA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | N(C([C@@](N1C(NCCC1)=O)(C(C)C)[H])=O)[C@](C[C@@]([C@](Cc1ccccc1)(NC(COc1c(C)cccc1C)=O)[H])(O)[H])(Cc1ccccc1)[H] |
| Source of Spectrum | Forensic Spectral Research |
| Synonyms | A-157378.0; ABT-378 |
| Technique | ATR-Neat |