PMC:7571312 / 54682-55728
Annnotations
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T484 | 250-251 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T485 | 894-896 | http://purl.obolibrary.org/obo/CLO_0007874 | denotes | MS |
T486 | 929-934 | http://purl.obolibrary.org/obo/CLO_0007706 | denotes | M + H |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T44136 | 72-79 | Chemical | denotes | methoxy | http://purl.obolibrary.org/obo/CHEBI_32772|http://purl.obolibrary.org/obo/CHEBI_44520 |
T72315 | 80-93 | Chemical | denotes | 1H-indol-2-yl | http://purl.obolibrary.org/obo/CHEBI_51611 |
T80123 | 80-82 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T38371 | 94-102 | Chemical | denotes | carbonyl | http://purl.obolibrary.org/obo/CHEBI_23019 |
T84329 | 106-112 | Chemical | denotes | leucyl | http://purl.obolibrary.org/obo/CHEBI_32630|http://purl.obolibrary.org/obo/CHEBI_37904 |
T18805 | 113-118 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T29990 | 122-125 | Chemical | denotes | oxo | http://purl.obolibrary.org/obo/CHEBI_46629 |
T16489 | 155-168 | Chemical | denotes | butyl acetate | http://purl.obolibrary.org/obo/CHEBI_31328 |
T52074 | 155-160 | Chemical | denotes | butyl | http://purl.obolibrary.org/obo/CHEBI_41264 |
T82193 | 161-168 | Chemical | denotes | acetate | http://purl.obolibrary.org/obo/CHEBI_30089|http://purl.obolibrary.org/obo/CHEBI_47622 |
T58673 | 186-206 | Chemical | denotes | 4-methylbenzoic acid | http://purl.obolibrary.org/obo/CHEBI_36635 |
T4356 | 188-206 | Chemical | denotes | methylbenzoic acid | http://purl.obolibrary.org/obo/CHEBI_25280 |
T58977 | 202-206 | Chemical | denotes | acid | http://purl.obolibrary.org/obo/CHEBI_37527 |
T76679 | 326-334 | Chemical | denotes | methanol | http://purl.obolibrary.org/obo/CHEBI_17790 |
T88844 | 335-350 | Chemical | denotes | dichloromethane | http://purl.obolibrary.org/obo/CHEBI_15767 |
T43261 | 397-399 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T87223 | 414-418 | Chemical | denotes | DMSO | http://purl.obolibrary.org/obo/CHEBI_28262 |
T97389 | 447-449 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T63097 | 473-475 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T52721 | 499-501 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T20525 | 539-541 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T70463 | 565-567 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T48645 | 617-619 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T85643 | 636-638 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T81008 | 662-664 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T19507 | 676-678 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T59206 | 695-697 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T17149 | 780-782 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T6479 | 799-801 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T95796 | 818-820 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T96393 | 894-896 | Chemical | denotes | MS | http://purl.obolibrary.org/obo/CHEBI_73613 |
T60033 | 970-973 | Chemical | denotes | H2O | http://purl.obolibrary.org/obo/CHEBI_15377 |
T82823 | 979-982 | Chemical | denotes | DCM | http://purl.obolibrary.org/obo/CHEBI_15767 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T354 | 0-266 | 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 4-methylbenzoic acid and making noncritical variations provided a crude product. |
T355 | 267-396 | Sentence | denotes | This material was purified by Biotage MPLC (25 M, 2.5–4.5% methanol/dichloromethane) to afford 92 mg (44%) of the title compound. |
T356 | 397-937 | Sentence | denotes | 1H NMR (400 MHz, DMSO-d6) δ 11.59 (d, J = 1.8 Hz, 1H), 8.63 (d, J = 8.1 Hz, 1H), 8.46 (d, J = 7.6 Hz, 1H), 7.87 (d, J = 8.1 Hz, 2H), 7.65 (s, 1H), 7.37 (d, J = 1.8 Hz, 1H), 7.34 (d, J = 8.3 Hz, 2H), 7.08 (t, J = 8.0 Hz, 1H), 6.97–7.01 (m, 1H), 6.50 (d, J = 7.8 Hz, 1H), 5.09 (s, 1H), 5.03–5.20 (m, 1H), 4.43–4.52 (m, 2H), 3.87 (s, 3H), 3.04–3.17 (m, 2H), 2.38 (s, 3H), 2.28–2.34 (m, 1H), 2.06–2.14 (m, 1H), 1.96–2.06 (m, 1H), 1.51–1.78 (m, 5H), 0.94 (d, J = 6.3 Hz, 3H), 0.89 (d, J = 6.3 Hz, 3H); MS (ESI+) for C32H38N4O7m/z 591.2 (M + H)+. |
T357 | 938-1011 | Sentence | denotes | Anal. calcd for C32H38N4O7·0.10 H2O·0.11 DCM: C, 64.08; H, 6.43; N, 9.31. |
T358 | 1012-1046 | Sentence | denotes | Found: C, 64.36; H, 6.41; N, 8.92. |
LitCovid-PD-HP
Id | Subject | Object | Predicate | Lexical cue | hp_id |
---|---|---|---|---|---|
T8 | 979-982 | Phenotype | denotes | DCM | http://purl.obolibrary.org/obo/HP_0001644 |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
1238 | 186-206 | Chemical | denotes | 4-methylbenzoic acid | MESH:C009504 |
1239 | 326-334 | Chemical | denotes | methanol | MESH:D000432 |
1240 | 335-350 | Chemical | denotes | dichloromethane | MESH:D008752 |
1241 | 954-964 | Chemical | denotes | C32H38N4O7 | |
1242 | 970-973 | Chemical | denotes | H2O | |
1243 | 979-982 | Chemical | denotes | DCM | MESH:D008752 |
1244 | 984-985 | Chemical | denotes | C | MESH:D002244 |
1245 | 1003-1004 | Chemical | denotes | N | MESH:D009584 |
1246 | 1019-1020 | Chemical | denotes | C | MESH:D002244 |
1247 | 1038-1039 | Chemical | denotes | N | MESH:D009584 |