PMC:7571312 / 51336-52247
Annnotations
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T474 | 242-243 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T475 | 768-770 | http://purl.obolibrary.org/obo/CLO_0007874 | denotes | MS |
T476 | 803-808 | http://purl.obolibrary.org/obo/CLO_0007706 | denotes | M + H |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T71989 | 72-79 | Chemical | denotes | methoxy | http://purl.obolibrary.org/obo/CHEBI_32772|http://purl.obolibrary.org/obo/CHEBI_44520 |
T37846 | 80-93 | Chemical | denotes | 1H-indol-2-yl | http://purl.obolibrary.org/obo/CHEBI_51611 |
T86199 | 80-82 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T94436 | 94-102 | Chemical | denotes | carbonyl | http://purl.obolibrary.org/obo/CHEBI_23019 |
T72503 | 106-112 | Chemical | denotes | leucyl | http://purl.obolibrary.org/obo/CHEBI_32630|http://purl.obolibrary.org/obo/CHEBI_37904 |
T48336 | 113-118 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T27045 | 122-125 | Chemical | denotes | oxo | http://purl.obolibrary.org/obo/CHEBI_46629 |
T19478 | 155-168 | Chemical | denotes | butyl acetate | http://purl.obolibrary.org/obo/CHEBI_31328 |
T106 | 155-160 | Chemical | denotes | butyl | http://purl.obolibrary.org/obo/CHEBI_41264 |
T86264 | 161-168 | Chemical | denotes | acetate | http://purl.obolibrary.org/obo/CHEBI_30089|http://purl.obolibrary.org/obo/CHEBI_47622 |
T5769 | 186-198 | Chemical | denotes | pivalic acid | http://purl.obolibrary.org/obo/CHEBI_45133 |
T3867 | 194-198 | Chemical | denotes | acid | http://purl.obolibrary.org/obo/CHEBI_37527 |
T111 | 318-326 | Chemical | denotes | methanol | http://purl.obolibrary.org/obo/CHEBI_17790 |
T3238 | 327-342 | Chemical | denotes | dichloromethane | http://purl.obolibrary.org/obo/CHEBI_15767 |
T22213 | 390-392 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T114 | 407-411 | Chemical | denotes | DMSO | http://purl.obolibrary.org/obo/CHEBI_28262 |
T26714 | 428-430 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T54523 | 454-456 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T10730 | 480-482 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T38064 | 494-496 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T79920 | 508-510 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T99227 | 534-536 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T94617 | 548-550 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T6524 | 574-576 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T53306 | 588-590 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T47671 | 607-609 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T69670 | 768-770 | Chemical | denotes | MS | http://purl.obolibrary.org/obo/CHEBI_73613 |
T41002 | 844-847 | Chemical | denotes | H2O | http://purl.obolibrary.org/obo/CHEBI_15377 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T336 | 0-258 | 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 pivalic acid and making noncritical variations provided a crude product. |
T337 | 259-389 | Sentence | denotes | This material was purified by Biotage MPLC (25 M, 2.5–4.5% methanol/dichloromethane) to afford 152 mg (78%) of the title compound. |
T338 | 390-811 | Sentence | denotes | 1H NMR (400 MHz, DMSO-d6) δ 11.58 (s, 1H), 8.56 (d, J = 7.8 Hz, 1H), 8.44 (d, J = 7.8 Hz, 1H), 7.64 (s, 1H), 7.36 (s, 1H), 7.08 (t, J = 8.0 Hz, 1H), 6.99 (d, 1H), 6.49 (d, J = 7.6 Hz, 1H), 4.84 (s, 1H), 4.77–4.94 (m, 1H), 4.34–4.51 (m, 2H), 3.87 (s, 3H), 3.02–3.16 (m, 2H), 1.91–2.36 (m, 3H), 1.48–1.78 (m, 5H), 1.16 (s, 9H), 0.94 (d, J = 6.3 Hz, 3H), 0.89 (d, J = 6.3 Hz, 3H); MS (ESI+) for C29H40N4O7m/z 557.2 (M + H)+. |
T339 | 812-876 | Sentence | denotes | Anal. calcd for C29H40N4O7·0.76 H2O: C, 61.07; H, 7.34; N, 9.82. |
T340 | 877-911 | Sentence | denotes | Found: C, 61.14; H, 7.63; N, 9.59. |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
1181 | 186-198 | Chemical | denotes | pivalic acid | MESH:C005566 |
1182 | 318-326 | Chemical | denotes | methanol | MESH:D000432 |
1183 | 327-342 | Chemical | denotes | dichloromethane | MESH:D008752 |
1184 | 828-838 | Chemical | denotes | C29H40N4O7 | |
1185 | 844-847 | Chemical | denotes | H2O | |
1186 | 849-850 | Chemical | denotes | C | MESH:D002244 |
1187 | 868-869 | Chemical | denotes | N | MESH:D009584 |
1188 | 884-885 | Chemical | denotes | C | MESH:D002244 |
1189 | 903-904 | Chemical | denotes | N | MESH:D009584 |