PMC:7291971 / 37511-38794
Annnotations
LitCovid-PMC-OGER-BB
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T771 | 49-68 | CHEBI:53233;CHEBI:53233 | denotes | dimethyl-tetrahydro |
T772 | 69-71 | CHEBI:53233;CHEBI:53233 | denotes | 2H |
T773 | 76-79 | CHEBI:53233;CHEBI:53233 | denotes | [3, |
T774 | 80-81 | CHEBI:53233;CHEBI:53233 | denotes | - |
T775 | 85-86 | CHEBI:53233;CHEBI:53233 | denotes | 1 |
T776 | 86-88 | CHEBI:52029;CHEBI:52029 | denotes | ,3 |
T777 | 88-101 | CHEBI:53233;CHEBI:53233 | denotes | ]dioxol-4-yl] |
T778 | 158-159 | CHEBI:53233;CHEBI:53233 | denotes | - |
T779 | 159-177 | CHEBI:28714;CHEBI:28714 | denotes | butyldimethylsilyl |
T780 | 178-181 | CHEBI:29354;CHEBI:29354 | denotes | oxy |
T781 | 182-186 | CHEBI:53233;CHEBI:53233 | denotes | -5-{ |
T782 | 187-193 | CHEBI:53233;CHEBI:53233 | denotes | (tert- |
T783 | 193-211 | CHEBI:8502;CHEBI:8502 | denotes | butyldimethylsilyl |
T784 | 211-212 | CHEBI:53233;CHEBI:53233 | denotes | ) |
T785 | 212-215 | CHEBI:29354;CHEBI:29354 | denotes | oxy |
T786 | 216-222 | CHEBI:16625;CHEBI:16625 | denotes | methyl |
T787 | 223-235 | CHEBI:53233;CHEBI:53233 | denotes | oxolan-3-yl] |
T788 | 235-238 | CHEBI:15533;CHEBI:15533 | denotes | oxy |
T789 | 245-248 | CHEBI:86228;CHEBI:86228 | denotes | -4- |
T790 | 248-260 | CHEBI:27798;CHEBI:27798 | denotes | nitrobenzene |
T791 | 260-263 | CHEBI:86228;CHEBI:86228 | denotes | -1- |
T792 | 263-274 | CHEBI:35358;CHEBI:35358 | denotes | sulfonamide |
T793 | 407-411 | CHEBI:32145;CHEBI:32145 | denotes | MeOH |
T794 | 435-440 | CHEBI:30808;CHEBI:30808 | denotes | CDCl3 |
T795 | 939-942 | CHEBI:36927;CHEBI:36927 | denotes | 13C |
T68367 | 49-68 | CHEBI:53233;CHEBI:53233 | denotes | dimethyl-tetrahydro |
T40445 | 69-71 | CHEBI:53233;CHEBI:53233 | denotes | 2H |
T4224 | 76-79 | CHEBI:53233;CHEBI:53233 | denotes | [3, |
T91423 | 80-81 | CHEBI:53233;CHEBI:53233 | denotes | - |
T12675 | 85-86 | CHEBI:53233;CHEBI:53233 | denotes | 1 |
T79796 | 86-88 | CHEBI:52029;CHEBI:52029 | denotes | ,3 |
T73827 | 88-101 | CHEBI:53233;CHEBI:53233 | denotes | ]dioxol-4-yl] |
T62607 | 158-159 | CHEBI:53233;CHEBI:53233 | denotes | - |
T53578 | 159-177 | CHEBI:28714;CHEBI:28714 | denotes | butyldimethylsilyl |
T64666 | 178-181 | CHEBI:29354;CHEBI:29354 | denotes | oxy |
T28006 | 182-186 | CHEBI:53233;CHEBI:53233 | denotes | -5-{ |
T25194 | 187-193 | CHEBI:53233;CHEBI:53233 | denotes | (tert- |
T51661 | 193-211 | CHEBI:8502;CHEBI:8502 | denotes | butyldimethylsilyl |
T35859 | 211-212 | CHEBI:53233;CHEBI:53233 | denotes | ) |
T59756 | 212-215 | CHEBI:29354;CHEBI:29354 | denotes | oxy |
T74145 | 216-222 | CHEBI:16625;CHEBI:16625 | denotes | methyl |
T18351 | 223-235 | CHEBI:53233;CHEBI:53233 | denotes | oxolan-3-yl] |
T71610 | 235-238 | CHEBI:15533;CHEBI:15533 | denotes | oxy |
T27362 | 245-248 | CHEBI:86228;CHEBI:86228 | denotes | -4- |
T98530 | 248-260 | CHEBI:27798;CHEBI:27798 | denotes | nitrobenzene |
T56202 | 260-263 | CHEBI:86228;CHEBI:86228 | denotes | -1- |
T15954 | 263-274 | CHEBI:35358;CHEBI:35358 | denotes | sulfonamide |
T27636 | 407-411 | CHEBI:32145;CHEBI:32145 | denotes | MeOH |
T70470 | 435-440 | CHEBI:30808;CHEBI:30808 | denotes | CDCl3 |
T31867 | 939-942 | CHEBI:36927;CHEBI:36927 | denotes | 13C |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
656 | 407-411 | Chemical | denotes | MeOH |
657 | 412-415 | Chemical | denotes | DCM |
658 | 1230-1246 | Chemical | denotes | C43H65N12O11SSi2 |
659 | 1203-1207 | Disease | denotes | HRMS |
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T282 | 297-298 | http://purl.obolibrary.org/obo/CLO_0001021 | denotes | B |
T283 | 305-307 | http://purl.obolibrary.org/obo/CLO_0050510 | denotes | 18 |
T284 | 371-372 | http://purl.obolibrary.org/obo/CLO_0001020 | denotes | a |
T285 | 1248-1251 | http://purl.obolibrary.org/obo/CLO_0007706 | denotes | M+H |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T626 | 22-43 | Chemical | denotes | 6-amino-9H-purin-9-yl | http://purl.obolibrary.org/obo/CHEBI_30756 |
T627 | 24-29 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T628 | 49-57 | Chemical | denotes | dimethyl | http://purl.obolibrary.org/obo/CHEBI_33601|http://purl.obolibrary.org/obo/CHEBI_42266 |
T630 | 101-107 | Chemical | denotes | methyl | http://purl.obolibrary.org/obo/CHEBI_32875|http://purl.obolibrary.org/obo/CHEBI_29309 |
T632 | 127-148 | Chemical | denotes | 6-amino-9H-purin-9-yl | http://purl.obolibrary.org/obo/CHEBI_30756 |
T633 | 129-134 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T634 | 178-181 | Chemical | denotes | oxy | http://purl.obolibrary.org/obo/CHEBI_29354 |
T635 | 212-215 | Chemical | denotes | oxy | http://purl.obolibrary.org/obo/CHEBI_29354 |
T636 | 216-222 | Chemical | denotes | methyl | http://purl.obolibrary.org/obo/CHEBI_32875|http://purl.obolibrary.org/obo/CHEBI_29309 |
T638 | 235-238 | Chemical | denotes | oxy | http://purl.obolibrary.org/obo/CHEBI_29354 |
T639 | 239-244 | Chemical | denotes | ethyl | http://purl.obolibrary.org/obo/CHEBI_37807|http://purl.obolibrary.org/obo/CHEBI_62801 |
T641 | 248-260 | Chemical | denotes | nitrobenzene | http://purl.obolibrary.org/obo/CHEBI_27798 |
T642 | 263-274 | Chemical | denotes | sulfonamide | http://purl.obolibrary.org/obo/CHEBI_35358 |
T643 | 392-394 | Chemical | denotes | Rf | http://purl.obolibrary.org/obo/CHEBI_33346 |
T644 | 407-411 | Chemical | denotes | MeOH | http://purl.obolibrary.org/obo/CHEBI_17790 |
T645 | 412-415 | Chemical | denotes | DCM | http://purl.obolibrary.org/obo/CHEBI_15767 |
T646 | 418-420 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T647 | 435-440 | Chemical | denotes | CDCl3 | http://purl.obolibrary.org/obo/CHEBI_85365 |
T648 | 468-470 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T649 | 501-503 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T650 | 565-567 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T651 | 604-606 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T652 | 643-645 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T653 | 682-684 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T654 | 721-723 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T655 | 760-762 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T656 | 799-801 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T657 | 839-841 | Chemical | denotes | 1H | http://purl.obolibrary.org/obo/CHEBI_49637 |
T658 | 957-962 | Chemical | denotes | CDCl3 | http://purl.obolibrary.org/obo/CHEBI_85365 |
LitCovid-PD-HP
Id | Subject | Object | Predicate | Lexical cue | hp_id |
---|---|---|---|---|---|
T6 | 412-415 | Phenotype | denotes | DCM | http://purl.obolibrary.org/obo/HP_0001644 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T279 | 0-279 | Sentence | denotes | 4.1.5 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}-N-(2-{[(2R,5R)-2-(6-amino-9H-purin-9-yl)-4-[(tert-butyldimethylsilyl)oxy]-5-{[(tert-butyldimethylsilyl)oxy]methyl}oxolan-3-yl]oxy}ethyl)-4-nitrobenzene-1-sulfonamide (19) |
T280 | 280-391 | Sentence | denotes | Following method B using 18 (290 mg, 0.59 mmol, 1.00 eq), 19 (450 mg, 74%) was obtained as a pale yellow solid. |
T281 | 392-417 | Sentence | denotes | Rf 0.60 (10:90 MeOH/DCM). |
T282 | 418-938 | Sentence | denotes | 1H NMR (600 MHz, CDCl3) δ 8.30 (2s, 2H), 8.14 (s, 1H), 8.03–7.98 (m, 2H), 7.74 (s, 1H), 7.70–7.66 (m, 2H), 6.11–5.93 (m, 5H), 5.89 (d, J = 1.9 Hz, 1H), 5.35 (dd, J = 6.4 Hz, J = 1.9 Hz, 1H), 5.04 (dd, J = 6.4 Hz, J = 3.8 Hz, 1H), 4.51 (dd, J = 6.1 Hz, J = 4.6 Hz, 1H), 4.43 (dt, J = 8.5 Hz, J = 4.2 Hz, 1H), 4.22 (dd, J = 4.7 Hz, J = 3.2 Hz, 1H), 4.05 (dt, J = 5.9 Hz, J = 3.0 Hz, 1H), 3.99 (dd, J = 11.5 Hz, J = 3.5 Hz, 1H), 3.85–3.41 (m, 7H), 1.57 (s, 3H), 1.35 (s, 3H), 0.92 (s, 9H), 0.91 (s, 9H), 0.14–0.04 (m, 12H). |
T283 | 939-1202 | Sentence | denotes | 13C NMR (150 MHz, CDCl3) δ 155.8, 155.5, 153.2, 153.0, 149.7, 149.5, 148.9, 145.4, 140.2, 139.5, 128.4, 123.8, 120.5, 120.2, 114.7, 90.7, 87.3, 85.0, 84.5, 84.2, 82.8, 82.6, 69.7, 69.6, 61.5, 50.7, 47.7, 27.3, 26.2, 25.9, 25.4, 18.6, 18.2, −4.4, −4.7, −5.2, −5.3. |
T284 | 1203-1254 | Sentence | denotes | HRMS (ESI+): m/z calcd for C43H65N12O11SSi2 [M+H]+: |
T285 | 1255-1272 | Sentence | denotes | 1013.4155, found: |
T286 | 1273-1283 | Sentence | denotes | 1013.4155. |