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PMC:7291971 / 71277-72540 JSONTXT

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LitCovid-PMC-OGER-BB

Id Subject Object Predicate Lexical cue
T1428 50-65 CHEBI:50488;CHEBI:50488 denotes dihydroxyoxolan
T1429 66-67 CHEBI:53233;CHEBI:53233 denotes 2
T1430 68-71 CHEBI:53233;CHEBI:53233 denotes yl]
T1431 71-77 CHEBI:29309;CHEBI:29309 denotes methyl
T1432 108-118 CHEBI:30756;CHEBI:30756 denotes purin-9-yl
T1433 120-122 CHEBI:53233;CHEBI:53233 denotes 4-
T1434 122-129 CHEBI:43176;CHEBI:43176 denotes hydroxy
T1435 130-131 CHEBI:34018;CHEBI:34018 denotes 5
T1436 133-146 CHEBI:24712;CHEBI:24712 denotes hydroxymethyl
T1437 147-153 CHEBI:26911;CHEBI:26911 denotes oxolan
T1438 153-154 CHEBI:15533;CHEBI:15533 denotes -
T1439 154-155 CHEBI:53233;CHEBI:53233 denotes 3
T1440 155-158 CHEBI:15533;CHEBI:15533 denotes -yl
T1441 159-162 CHEBI:15533;CHEBI:15533 denotes oxy
T1442 172-179 CHEBI:44520;CHEBI:44520 denotes methoxy
T1443 179-182 CHEBI:86228;CHEBI:86228 denotes -4-
T1444 182-194 CHEBI:27798;CHEBI:27798 denotes nitrobenzene
T1445 194-197 CHEBI:86228;CHEBI:86228 denotes -1-
T1446 197-208 CHEBI:35358;CHEBI:35358 denotes sulfonamide
T1447 297-309 CHEBI:38472;CHEBI:38472 denotes acetonitrile
T1448 969-972 CHEBI:36927;CHEBI:36927 denotes 13C
T9646 50-65 CHEBI:50488;CHEBI:50488 denotes dihydroxyoxolan
T9486 66-67 CHEBI:53233;CHEBI:53233 denotes 2
T17557 68-71 CHEBI:53233;CHEBI:53233 denotes yl]
T47501 71-77 CHEBI:29309;CHEBI:29309 denotes methyl
T76951 108-118 CHEBI:30756;CHEBI:30756 denotes purin-9-yl
T96155 120-122 CHEBI:53233;CHEBI:53233 denotes 4-
T5259 122-129 CHEBI:43176;CHEBI:43176 denotes hydroxy
T85099 130-131 CHEBI:34018;CHEBI:34018 denotes 5
T50359 133-146 CHEBI:24712;CHEBI:24712 denotes hydroxymethyl
T76632 147-153 CHEBI:26911;CHEBI:26911 denotes oxolan
T56362 153-154 CHEBI:15533;CHEBI:15533 denotes -
T67443 154-155 CHEBI:53233;CHEBI:53233 denotes 3
T80801 155-158 CHEBI:15533;CHEBI:15533 denotes -yl
T80068 159-162 CHEBI:15533;CHEBI:15533 denotes oxy
T36872 172-179 CHEBI:44520;CHEBI:44520 denotes methoxy
T86174 179-182 CHEBI:86228;CHEBI:86228 denotes -4-
T19833 182-194 CHEBI:27798;CHEBI:27798 denotes nitrobenzene
T31704 194-197 CHEBI:86228;CHEBI:86228 denotes -1-
T76634 197-208 CHEBI:35358;CHEBI:35358 denotes sulfonamide
T76816 297-309 CHEBI:38472;CHEBI:38472 denotes acetonitrile
T69796 969-972 CHEBI:36927;CHEBI:36927 denotes 13C

LitCovid-PubTator

Id Subject Object Predicate Lexical cue tao:has_database_id
1302 297-309 Chemical denotes acetonitrile MESH:C032159
1303 313-318 Chemical denotes TEAAc
1304 458-460 Chemical denotes 1H
1305 475-481 Chemical denotes DMSO‑d
1306 496-498 Chemical denotes 1H
1307 510-512 Chemical denotes 1H
1308 524-526 Chemical denotes 2H MESH:D003903
1309 550-552 Chemical denotes 1H
1310 589-591 Chemical denotes 1H
1311 607-609 Chemical denotes 2H MESH:D003903
1312 625-627 Chemical denotes 2H MESH:D003903
1313 664-666 Chemical denotes 1H
1314 690-692 Chemical denotes 1H
1315 716-718 Chemical denotes 1H
1316 734-736 Chemical denotes 1H
1317 752-754 Chemical denotes 1H
1318 778-780 Chemical denotes 1H
1319 796-798 Chemical denotes 1H
1320 822-824 Chemical denotes 1H
1321 848-850 Chemical denotes 1H
1322 867-869 Chemical denotes 1H
1323 886-888 Chemical denotes 2H MESH:D003903
1324 912-914 Chemical denotes 1H
1325 926-928 Chemical denotes 3H MESH:D014316
1326 945-947 Chemical denotes 3H MESH:D014316
1327 964-966 Chemical denotes 5H
1328 1216-1229 Chemical denotes C29H35N12O12S
1329 1189-1193 Disease denotes HRMS

LitCovid-PD-CLO

Id Subject Object Predicate Lexical cue
T391 210-212 http://purl.obolibrary.org/obo/CLO_0053733 denotes 11
T392 270-271 http://purl.obolibrary.org/obo/CLO_0001020 denotes a
T393 356-358 http://purl.obolibrary.org/obo/CLO_0053733 denotes 11
T394 388-389 http://purl.obolibrary.org/obo/CLO_0001020 denotes a
T395 1231-1234 http://purl.obolibrary.org/obo/CLO_0007706 denotes M+H

LitCovid-PD-CHEBI

Id Subject Object Predicate Lexical cue chebi_id
T93847 23-44 Chemical denotes 6-amino-9H-purin-9-yl http://purl.obolibrary.org/obo/CHEBI_30756
T22848 25-30 Chemical denotes amino http://purl.obolibrary.org/obo/CHEBI_46882
T51289 71-77 Chemical denotes methyl http://purl.obolibrary.org/obo/CHEBI_32875|http://purl.obolibrary.org/obo/CHEBI_29309
T45430 97-118 Chemical denotes 6-amino-9H-purin-9-yl http://purl.obolibrary.org/obo/CHEBI_30756
T85865 99-104 Chemical denotes amino http://purl.obolibrary.org/obo/CHEBI_46882
T63263 122-129 Chemical denotes hydroxy http://purl.obolibrary.org/obo/CHEBI_43176
T54987 133-146 Chemical denotes hydroxymethyl http://purl.obolibrary.org/obo/CHEBI_24712
T56820 159-162 Chemical denotes oxy http://purl.obolibrary.org/obo/CHEBI_29354
T33381 163-168 Chemical denotes ethyl http://purl.obolibrary.org/obo/CHEBI_37807|http://purl.obolibrary.org/obo/CHEBI_62801
T53334 172-179 Chemical denotes methoxy http://purl.obolibrary.org/obo/CHEBI_32772|http://purl.obolibrary.org/obo/CHEBI_44520
T38495 182-194 Chemical denotes nitrobenzene http://purl.obolibrary.org/obo/CHEBI_27798
T38841 197-208 Chemical denotes sulfonamide http://purl.obolibrary.org/obo/CHEBI_35358
T15782 297-309 Chemical denotes acetonitrile http://purl.obolibrary.org/obo/CHEBI_38472
T34792 319-325 Chemical denotes buffer http://purl.obolibrary.org/obo/CHEBI_35225
T78354 458-460 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T14581 475-479 Chemical denotes DMSO http://purl.obolibrary.org/obo/CHEBI_28262
T22965 496-498 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T55962 510-512 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T48514 550-552 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T96071 589-591 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T88852 664-666 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T38568 690-692 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T31277 716-718 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T84482 734-736 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T30462 752-754 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T2044 778-780 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T90423 796-798 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T6961 822-824 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T12338 848-850 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T52243 867-869 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T81477 912-914 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T89255 987-991 Chemical denotes DMSO http://purl.obolibrary.org/obo/CHEBI_28262

LitCovid-sentences

Id Subject Object Predicate Lexical cue
T485 0-213 Sentence denotes 4.1.31 N-{[(2R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}-N-(2-{[(2R,5R)-2-(6-amino-9H-purin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}ethyl)-2-methoxy-4-nitrobenzene-1-sulfonamide (11)
T486 214-457 Sentence denotes Using method C with 31 (160 mg, 0.15 mmol, 1.00 eq) and a 0–40% linear gradient of acetonitrile in TEAAc buffer 50 mM, pH 7 for purification, 11 (15 mg, 13%) was obtained as a white powder with 98% purity determined by HPLC analysis at 260 nm.
T487 458-968 Sentence denotes 1H NMR (500 MHz, DMSO‑d 6) δ 8.32 (s, 1H), 8.28 (s, 1H), 8.13 (s, 2H), 7.77 (d, J = 9.0 Hz, 1H), 7.44 (dd, J = 8.5 Hz, J = 2.6 Hz, 1H), 7.34 (br. s, 2H), 7.29 (br. s, 2H), 6.99 (dd, J = 9.0 Hz, J = 2.6 Hz, 1H), 5.95 (d, J = 5.2 Hz, 1H), 5.83 (d, J = 5.5 Hz, 1H), 5.65 (br. s, 1H), 5.49 (br. s, 1H), 5.38 (t, J = 5.7 Hz, 1H), 5.27 (br. s, 1H), 4.66 (t, J = 5.2 Hz, 1H), 4.37 (t, J = 5.1 Hz, 1H), 4.33–4.27 (m, 1H), 4.17–4.08 (m, 2H), 3.93 (q, J = 3.6 Hz, 1H), 3.84 (s, 3H), 3.80–3.62 (m, 3H), 3.60–3.37 (m, 5H).
T488 969-1188 Sentence denotes 13C NMR (125 MHz, DMSO‑d 6) δ 156.9, 156.1, 155.9, 152.5, 152.4, 150.6, 149.0, 148.8, 134.0, 139.5, 133.7, 131.0, 119.2, 119.2, 114.4, 107.4, 87.8, 86.2, 85.9, 81.5, 81.4, 72.5, 71.3, 68.9, 66.7, 61.1, 56.8, 50.2, 47.1.
T489 1189-1237 Sentence denotes HRMS (ESI+): m/z calcd for C29H35N12O12S [M+H]+:
T490 1238-1263 Sentence denotes 775.2218, Found 775.2220.