PMC:7291971 / 63557-64530
Annnotations
LitCovid-PMC-OGER-BB
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T1273 | 50-82 | CHEBI:53233;CHEBI:53233 | denotes | dimethyl-tetrahydro-2H-furo[3,4- |
T1274 | 86-87 | CHEBI:53233;CHEBI:53233 | denotes | 1 |
T1275 | 87-89 | CHEBI:52029;CHEBI:52029 | denotes | ,3 |
T1276 | 89-102 | CHEBI:53233;CHEBI:53233 | denotes | ]dioxol-4-yl] |
T1277 | 102-108 | CHEBI:16625;CHEBI:16625 | denotes | methyl |
T1278 | 110-112 | CHEBI:53233;CHEBI:53233 | denotes | 4- |
T1279 | 112-118 | CHEBI:47853;CHEBI:47853 | denotes | chloro |
T1280 | 118-121 | CHEBI:86228;CHEBI:86228 | denotes | -3- |
T1281 | 121-133 | CHEBI:27798;CHEBI:27798 | denotes | nitrobenzene |
T1282 | 133-136 | CHEBI:86228;CHEBI:86228 | denotes | -1- |
T1283 | 136-147 | CHEBI:35358;CHEBI:35358 | denotes | sulfonamide |
T1284 | 177-179 | CHEBI:75508;CHEBI:75508 | denotes | 5′ |
T1285 | 179-180 | CHEBI:50217;CHEBI:50217 | denotes | - |
T1286 | 180-185 | CHEBI:46882;CHEBI:46882 | denotes | amino |
T1287 | 185-187 | CHEBI:50217;CHEBI:50217 | denotes | -2 |
T1288 | 187-206 | CHEBI:53250;CHEBI:53250 | denotes | ′,3′-isopropylidene |
T1289 | 207-216 | CHEBI:22260;CHEBI:22260 | denotes | adenosine |
T1290 | 250-252 | CHEBI:86228;CHEBI:86228 | denotes | 4- |
T1291 | 252-258 | CHEBI:47853;CHEBI:47853 | denotes | chloro |
T1292 | 258-280 | CHEBI:86228;CHEBI:86228 | denotes | -3-nitrobenzenesufonyl |
T1293 | 281-289 | CHEBI:17996;CHEBI:17996 | denotes | chloride |
T1294 | 353-357 | CHEBI:32145;CHEBI:32145 | denotes | MeOH |
T1295 | 736-739 | CHEBI:36927;CHEBI:36927 | denotes | 13C |
T98719 | 50-82 | CHEBI:53233;CHEBI:53233 | denotes | dimethyl-tetrahydro-2H-furo[3,4- |
T64923 | 86-87 | CHEBI:53233;CHEBI:53233 | denotes | 1 |
T19618 | 87-89 | CHEBI:52029;CHEBI:52029 | denotes | ,3 |
T21752 | 89-102 | CHEBI:53233;CHEBI:53233 | denotes | ]dioxol-4-yl] |
T69104 | 102-108 | CHEBI:16625;CHEBI:16625 | denotes | methyl |
T6973 | 110-112 | CHEBI:53233;CHEBI:53233 | denotes | 4- |
T6632 | 112-118 | CHEBI:47853;CHEBI:47853 | denotes | chloro |
T32297 | 118-121 | CHEBI:86228;CHEBI:86228 | denotes | -3- |
T3937 | 121-133 | CHEBI:27798;CHEBI:27798 | denotes | nitrobenzene |
T22911 | 133-136 | CHEBI:86228;CHEBI:86228 | denotes | -1- |
T94422 | 136-147 | CHEBI:35358;CHEBI:35358 | denotes | sulfonamide |
T41796 | 177-179 | CHEBI:75508;CHEBI:75508 | denotes | 5′ |
T29317 | 179-180 | CHEBI:50217;CHEBI:50217 | denotes | - |
T14374 | 180-185 | CHEBI:46882;CHEBI:46882 | denotes | amino |
T34149 | 185-187 | CHEBI:50217;CHEBI:50217 | denotes | -2 |
T75460 | 187-206 | CHEBI:53250;CHEBI:53250 | denotes | ′,3′-isopropylidene |
T57966 | 207-216 | CHEBI:22260;CHEBI:22260 | denotes | adenosine |
T37315 | 250-252 | CHEBI:86228;CHEBI:86228 | denotes | 4- |
T51836 | 252-258 | CHEBI:47853;CHEBI:47853 | denotes | chloro |
T55660 | 258-280 | CHEBI:86228;CHEBI:86228 | denotes | -3-nitrobenzenesufonyl |
T3877 | 281-289 | CHEBI:17996;CHEBI:17996 | denotes | chloride |
T85531 | 353-357 | CHEBI:32145;CHEBI:32145 | denotes | MeOH |
T63694 | 736-739 | CHEBI:36927;CHEBI:36927 | denotes | 13C |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
1156 | 207-216 | Chemical | denotes | adenosine | MESH:D000241 |
1157 | 250-289 | Chemical | denotes | 4-chloro-3-nitrobenzenesufonyl chloride | |
1158 | 353-357 | Chemical | denotes | MeOH | |
1159 | 358-364 | Chemical | denotes | CH2Cl2 | |
1160 | 367-369 | Chemical | denotes | 1H | |
1161 | 384-390 | Chemical | denotes | DMSO‑d | |
1162 | 405-407 | Chemical | denotes | 1H | |
1163 | 431-433 | Chemical | denotes | 1H | |
1164 | 445-447 | Chemical | denotes | 1H | |
1165 | 459-461 | Chemical | denotes | 1H | |
1166 | 498-500 | Chemical | denotes | 1H | |
1167 | 524-526 | Chemical | denotes | 1H | |
1168 | 736-739 | Chemical | denotes | 13C | MESH:C000615229 |
1169 | 754-762 | Chemical | denotes | DMSO‑d 6 | |
1170 | 926-939 | Chemical | denotes | C19H21N7O7SCl | |
1171 | 899-903 | Disease | denotes | HRMS |
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T369 | 170-171 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | A |
T370 | 324-325 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T371 | 941-944 | http://purl.obolibrary.org/obo/CLO_0007706 | denotes | M+H |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T50217 | 23-44 | Chemical | denotes | 6-amino-9H-purin-9-yl | http://purl.obolibrary.org/obo/CHEBI_30756 |
T43169 | 25-30 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T42743 | 50-58 | Chemical | denotes | dimethyl | http://purl.obolibrary.org/obo/CHEBI_33601|http://purl.obolibrary.org/obo/CHEBI_42266 |
T87205 | 102-108 | Chemical | denotes | methyl | http://purl.obolibrary.org/obo/CHEBI_32875|http://purl.obolibrary.org/obo/CHEBI_29309 |
T25385 | 112-118 | Chemical | denotes | chloro | http://purl.obolibrary.org/obo/CHEBI_47853 |
T43755 | 121-133 | Chemical | denotes | nitrobenzene | http://purl.obolibrary.org/obo/CHEBI_27798 |
T373 | 136-147 | Chemical | denotes | sulfonamide | http://purl.obolibrary.org/obo/CHEBI_35358 |
T78338 | 180-185 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T86776 | 192-206 | Chemical | denotes | isopropylidene | http://purl.obolibrary.org/obo/CHEBI_29858 |
T376 | 207-216 | Chemical | denotes | adenosine | http://purl.obolibrary.org/obo/CHEBI_16335 |
T92152 | 252-258 | Chemical | denotes | chloro | http://purl.obolibrary.org/obo/CHEBI_47853 |
T10656 | 281-289 | Chemical | denotes | chloride | http://purl.obolibrary.org/obo/CHEBI_17996 |
T62047 | 339-341 | Chemical | denotes | Rf | http://purl.obolibrary.org/obo/CHEBI_33346 |
T62948 | 353-357 | Chemical | denotes | MeOH | http://purl.obolibrary.org/obo/CHEBI_17790 |
T13967 | 367-369 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T24399 | 384-388 | Chemical | denotes | DMSO | http://purl.obolibrary.org/obo/CHEBI_28262 |
T9330 | 405-407 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T73417 | 431-433 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T39372 | 445-447 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T59648 | 459-461 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T66135 | 498-500 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T48396 | 524-526 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T4269 | 568-570 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T13812 | 607-609 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T44374 | 646-648 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T91535 | 684-686 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T95896 | 754-758 | Chemical | denotes | DMSO | http://purl.obolibrary.org/obo/CHEBI_28262 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T440 | 0-152 | Sentence | denotes | 4.1.25 N-{[(4R,6R)-6-(6-amino-9H-purin-9-yl)-2,2-dimethyl-tetrahydro-2H-furo[3,4-d] [1,3]dioxol-4-yl]methyl}-4-chloro-3-nitrobenzene-1-sulfonamide (29) |
T441 | 153-338 | Sentence | denotes | Following method A with 5′-amino-2′,3′-isopropylidene adenosine (280 mg, 0.92 mmol, 1.00 eq) and 4-chloro-3-nitrobenzenesufonyl chloride, 29 (346 mg, 72%) was obtained as a brown solid. |
T442 | 339-366 | Sentence | denotes | Rf 0.42 (8:92 MeOH/CH2Cl2). |
T443 | 367-735 | Sentence | denotes | 1H NMR (400 MHz, DMSO‑d 6) δ 8.56 (s, 1H), 8.39 (d, J = 2.1 Hz, 1H), 8.27 (s, 1H), 8.14 (s, 1H), 7.96 (dd, J = 8.5 Hz, J = 2.1 Hz, 1H), 7.90 (d, J = 8.5 Hz, 1H), 7.37 (br. s, 2H), 6.12 (d, J = 2.8 Hz, 1H), 5.34 (dd, J = 6.3 Hz, J = 2.9 Hz, 1H), 4.89 (dd, J = 6.3 Hz, J = 3.1 Hz, 1H) 4.17 (td, J = 5.9 Hz, J = 3.0 Hz, 1H), 3.33–3.18 (m, 2H), 1.51 (s, 3H), 1.29 (s, 3H). |
T444 | 736-898 | Sentence | denotes | 13C NMR (100 MHz, DMSO‑d 6) δ 156.7, 153.0, 148.9, 147.8, 141.1, 140.6, 133.4, 131.6, 129.8, 124.4, 119.7, 114.0, 107.7, 89.8, 84.7, 83.4, 82.0, 44.9, 27.4, 25.6. |
T445 | 899-947 | Sentence | denotes | HRMS (ESI+): m/z calcd for C19H21N7O7SCl [M+H]+: |
T446 | 948-973 | Sentence | denotes | 526.0912, Found 526.0914. |