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PMC:7291971 / 59040-60006 JSONTXT

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LitCovid-PMC-OGER-BB

Id Subject Object Predicate Lexical cue
T1195 83-95 CHEBI:38472;CHEBI:38472 denotes acetonitrile
T1196 692-695 CHEBI:36927;CHEBI:36927 denotes 13C
T65427 83-95 CHEBI:38472;CHEBI:38472 denotes acetonitrile
T35276 692-695 CHEBI:36927;CHEBI:36927 denotes 13C

LitCovid-PubTator

Id Subject Object Predicate Lexical cue tao:has_database_id
1021 83-95 Chemical denotes acetonitrile MESH:C032159
1022 99-104 Chemical denotes TEAAc
1023 243-245 Chemical denotes 1H
1024 260-266 Chemical denotes DMSO‑d
1025 281-283 Chemical denotes 1H
1026 295-297 Chemical denotes 1H
1027 314-316 Chemical denotes 2H MESH:D003903
1028 328-330 Chemical denotes 1H
1029 342-344 Chemical denotes 1H
1030 361-363 Chemical denotes 2H MESH:D003903
1031 379-381 Chemical denotes 2H MESH:D003903
1032 692-695 Chemical denotes 13C MESH:C000615229
1033 710-718 Chemical denotes DMSO‑d 6
1034 919-932 Chemical denotes C28H33N12O11S
1035 892-896 Disease denotes HRMS

LitCovid-PD-CLO

Id Subject Object Predicate Lexical cue
T351 56-57 http://purl.obolibrary.org/obo/CLO_0001020 denotes a
T352 152-154 http://purl.obolibrary.org/obo/CLO_0001302 denotes 34
T353 173-174 http://purl.obolibrary.org/obo/CLO_0001020 denotes a
T354 934-937 http://purl.obolibrary.org/obo/CLO_0007706 denotes M+H

LitCovid-PD-CHEBI

Id Subject Object Predicate Lexical cue chebi_id
T243 83-95 Chemical denotes acetonitrile http://purl.obolibrary.org/obo/CHEBI_38472
T56015 105-111 Chemical denotes buffer http://purl.obolibrary.org/obo/CHEBI_35225
T72768 243-245 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T91178 260-264 Chemical denotes DMSO http://purl.obolibrary.org/obo/CHEBI_28262
T96978 281-283 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T74178 295-297 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T87762 328-330 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T73030 342-344 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T72407 423-425 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T22886 449-451 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T40680 494-496 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T254 520-522 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T66835 539-541 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T28203 565-567 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T98164 604-606 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T69540 630-632 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T259 668-670 Chemical denotes 1H http://purl.obolibrary.org/obo/CHEBI_49637
T63532 710-714 Chemical denotes DMSO http://purl.obolibrary.org/obo/CHEBI_28262

LitCovid-sentences

Id Subject Object Predicate Lexical cue
T410 0-242 Sentence denotes Using method C with 19 (100 mg, 97.4 μmol, 1.00 eq) and a 0–40% linear gradient of acetonitrile in TEAAc buffer 50 mM, pH 7 for purification, 9 (25 mg, 34%) was obtained as a white powder with 99% purity determined by HPLC analysis at 260 nm.
T411 243-691 Sentence denotes 1H NMR (600 MHz, DMSO‑d 6) δ 8.32 (s, 1H), 8.29 (s, 1H), 8.22–8.18 (m, 2H), 8.14 (s, 1H), 8.13 (s, 1H), 7.96–7.91 (m, 2H), 7.32 (br. s, 2H), 7.26 (br. s, 2H), 5.89 (d, J = 5.4 Hz, 1H), 5.79 (d, J = 5.6 Hz, 1H), 5.73–5.20 (m, 4H), 4.70 (t, J = 5.4 Hz, 1H), 4.34 (t, J = 5.1 Hz, 1H), 4.30–4.26 (m, 1H), 4.15 (t, J = 4.6 Hz, 1H), 4.09 (dt, J = 8.5 Hz, J = 4.3 Hz, 1H), 3.89 (q, J = 3.6 Hz, 1H), 3.75–3.70 (m, 2H), 3.66–3.63 (m, 1H), 3.60–3.29 (m, 5H).
T412 692-891 Sentence denotes 13C NMR (150 MHz, DMSO‑d 6) δ 156.2, 156.2, 152.8, 152.7, 149.6, 149.3, 149.0, 145.0, 140.2, 139.6, 128.5, 124.3, 119.3, 119.3, 87.9, 86.3, 86.0, 82.9, 81.6, 72.5, 71.4, 70.0, 68.2, 61.2, 50.4, 47.5.
T413 892-940 Sentence denotes HRMS (ESI+): m/z calcd for C28H33N12O11S [M+H]+:
T414 941-966 Sentence denotes 745.2112, Found 745.2104.