PMC:7571312 / 59356-60364
Annnotations
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T497 | 254-255 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T498 | 301-303 | http://purl.obolibrary.org/obo/CL_0000453 | denotes | LC |
T499 | 358-361 | http://purl.obolibrary.org/obo/CLO_0053001 | denotes | 114 |
T500 | 396-397 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T501 | 795-797 | http://purl.obolibrary.org/obo/CLO_0007874 | denotes | MS |
T502 | 833-838 | http://purl.obolibrary.org/obo/CLO_0007706 | denotes | M + H |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T80476 | 72-79 | Chemical | denotes | methoxy | http://purl.obolibrary.org/obo/CHEBI_32772|http://purl.obolibrary.org/obo/CHEBI_44520 |
T17330 | 80-93 | Chemical | denotes | 1H-indol-2-yl | http://purl.obolibrary.org/obo/CHEBI_51611 |
T64183 | 80-82 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T400 | 94-102 | Chemical | denotes | carbonyl | http://purl.obolibrary.org/obo/CHEBI_23019 |
T87264 | 106-112 | Chemical | denotes | leucyl | http://purl.obolibrary.org/obo/CHEBI_32630|http://purl.obolibrary.org/obo/CHEBI_37904 |
T76187 | 113-118 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T404 | 122-125 | Chemical | denotes | oxo | http://purl.obolibrary.org/obo/CHEBI_46629 |
T46479 | 155-168 | Chemical | denotes | butyl acetate | http://purl.obolibrary.org/obo/CHEBI_31328 |
T87387 | 155-160 | Chemical | denotes | butyl | http://purl.obolibrary.org/obo/CHEBI_41264 |
T76732 | 161-168 | Chemical | denotes | acetate | http://purl.obolibrary.org/obo/CHEBI_30089|http://purl.obolibrary.org/obo/CHEBI_47622 |
T409 | 186-210 | Chemical | denotes | 2,6-dichlorobenzoic acid | http://purl.obolibrary.org/obo/CHEBI_48623 |
T96547 | 206-210 | Chemical | denotes | acid | http://purl.obolibrary.org/obo/CHEBI_37527 |
T6862 | 301-303 | Chemical | denotes | LC | http://purl.obolibrary.org/obo/CHEBI_73582 |
T2479 | 318-322 | Chemical | denotes | SiO2 | http://purl.obolibrary.org/obo/CHEBI_30563 |
T15870 | 327-335 | Chemical | denotes | methanol | http://purl.obolibrary.org/obo/CHEBI_17790 |
T44525 | 336-346 | Chemical | denotes | chloroform | http://purl.obolibrary.org/obo/CHEBI_35255 |
T64096 | 411-413 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T21640 | 419-423 | Chemical | denotes | DMSO | http://purl.obolibrary.org/obo/CHEBI_28262 |
T417 | 450-452 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T76959 | 474-476 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T77251 | 498-500 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T24704 | 531-533 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T24047 | 555-557 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T21248 | 579-581 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T423 | 603-605 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T76092 | 628-630 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T96814 | 653-655 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T70327 | 709-711 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T56820 | 795-797 | Chemical | denotes | MS | http://purl.obolibrary.org/obo/CHEBI_73613 |
T20891 | 876-879 | Chemical | denotes | H2O | http://purl.obolibrary.org/obo/CHEBI_15377 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T378 | 0-270 | Sentence | denotes | Following the procedure described for the preparation of (3S)-3-({N-[(4-methoxy-1H-indol-2-yl)carbonyl]-l-leucyl}amino)-2-oxo-4-[(3S)-2-oxopyrrolidin-3-yl]butyl acetate but substituting 2,6-dichlorobenzoic acid and making noncritical variations provided a crude product. |
T379 | 271-410 | Sentence | denotes | This material was purified by LC (20 g 230–400 SiO2, 3% methanol/chloroform) to afford 114 mg (65%) of the title compound as a white solid. |
T380 | 411-847 | Sentence | denotes | 1H NMR (DMSO-d6) δ 11.57 (d, J = 2 Hz, 1H), 8.62 (d, J = 8 Hz, 1H), 8.46 (d, J = 4 Hz, 1H), 7.65–7.53 (m, 4H), 7.36 (s, 1H), 7.08 (t, J = 8 Hz, 1H), 6.99 (d, J = 8 Hz, 1H), 6.49 (d, J = 8 Hz, 1H), 5.19 (d, J = 20 Hz, 1H), 5.15 (d, J = 20 Hz, 1H), 4.51 (m, 2H), 3.87 (s, 3H), 3.11 (m, 2H), 2.30 (m, 1H), 2.06 (m, 2H), 1.76–1.51 (m, 5H), 0.94 (d, J = 8 Hz, 3H), 0.89 (d, J = 8 Hz, 3H); MS (ESI+) for C31H34Cl2N4O7m/z 645.1 (M + H)+; Anal. |
T381 | 848-908 | Sentence | denotes | Calcd for C31H34Cl2N4O7·0.2 H2O: C, 57.36; H, 5.34; N, 8.63. |
T382 | 909-943 | Sentence | denotes | Found: C, 57.23; H, 5.55; N, 8.46. |
T383 | 944-1008 | Sentence | denotes | HRMS (ESI+) calcd for C31H34Cl2N4O7+H1 645.1877, found 645.1871. |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
1318 | 186-210 | Chemical | denotes | 2,6-dichlorobenzoic acid | |
1319 | 318-322 | Chemical | denotes | SiO2 | |
1320 | 327-335 | Chemical | denotes | methanol | MESH:D000432 |
1321 | 336-346 | Chemical | denotes | chloroform | MESH:D002725 |
1322 | 858-871 | Chemical | denotes | C31H34Cl2N4O7 | |
1323 | 876-879 | Chemical | denotes | H2O | |
1324 | 881-882 | Chemical | denotes | C | MESH:D002244 |
1325 | 900-901 | Chemical | denotes | N | MESH:D009584 |
1326 | 916-917 | Chemical | denotes | C | MESH:D002244 |
1327 | 935-936 | Chemical | denotes | N | MESH:D009584 |
1328 | 966-979 | Chemical | denotes | C31H34Cl2N4O7 | |
1329 | 944-948 | Disease | denotes | HRMS |