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Sodium Ion → HCID 67228155, 화합물

HRID 2338597
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HRID 2338597 반응식
[CH3:37][O:38][C:39](=[O:40])[c:41]1[cH:42][cH:43][c:44]([B:47]([OH:48])[OH:49])[cH:45][cH:46]1.[Na+:50].[Na+:51].[O-:52][C:53](=[O:54])[O-:55].[O:56]1[CH2:57][CH2:58][O:59][CH2:60][CH2:61]1.[Pd:62]([Cl:63])[Cl:64].[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[c:11]([C:19](=[CH:20][CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25]3)[O:26][S:27]([c:28]3[cH:29][cH:30][c:31]([CH3:32])[cH:33][cH:34]3)(=[O:35])=[O:36])[cH:12][c:13]3[c:14]2[n:15][cH:16][cH:17][cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1.[c:84]1([P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[cH:98][cH:99][cH:100][cH:101][cH:102]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[c:11]([C:19](=[CH:20][CH:21]3[CH2:22][CH2:23][CH2:24][CH2:25]3)[c:44]3[cH:43][cH:42][c:41]([C:39]([O:38][CH3:37])=[O:40])[cH:46][cH:45]3)[cH:12][c:13]3[c:14]2[n:15][cH:16][cH:17][cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium Ion2회HCID 11776Triphenylphosphine2회HCID 19660Carbonate IonHCID 24290Palladium ChlorideHCID 312751,4-DioxaneHCID 27343694-Methoxycarbonylphenylboronic acid
HCID 86654505
toluene-4-sulfonic acid 1-(1-benzenesulfonyl-1H-pyrrolo[2,3-b]pyridin-2-yl)-2-cyclopentyl-vinyl ester

생성물 1

HCID 67228155HCID 67228155, 화합물

출처 및 근거

ORD 기록
ord-6c15568b3d9341c5a5bd4341bd4ad7ca
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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