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PMC:7291971 / 37511-38794 JSONTXT

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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.