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Sodium Ion → HCID 59738189, 화합물

HRID 1546976
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인쇄 미리보기

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HRID 1546976 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([Cl:29])[c:6]([O:7][CH:8]2[CH2:9][CH2:10][N:11]([c:14]3[n:15][o:16][c:17](-[c:19]4[n:20][n:21][n:22]([CH2:24][C:25](=[O:26])[OH:27])[n:23]4)[cH:18]3)[CH2:12][CH2:13]2)[cH:28]1.[C:44](=[O:45])([O-:46])[O-:47].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[F:30][C:31]([O:32][c:33]1[cH:34][cH:35][c:36]([B:39]([OH:40])[OH:41])[cH:37][cH:38]1)([F:42])[F:43].[Na+:48].[Na+:49].[cH:57]1[cH:58][cH:59][c:60]([P:61]([Pd:62]([P:63]([c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([P:82]([c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[P:101]([c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)([c:120]2[cH:121][cH:122][cH:123][cH:124][cH:125]2)[c:126]2[cH:127][cH:128][cH:129][cH:130][cH:131]2)[cH:132][cH:133]1>>[c:2]1(-[c:36]2[cH:35][cH:34][c:33]([O:32][C:31]([F:30])([F:42])[F:43])[cH:38][cH:37]2)[cH:3][cH:4][c:5]([Cl:29])[c:6]([O:7][CH:8]2[CH2:9][CH2:10][N:11]([c:14]3[n:15][o:16][c:17](-[c:19]4[n:20][n:21][n:22]([CH2:24][C:25](=[O:26])[OH:27])[n:23]4)[cH:18]3)[CH2:12][CH2:13]2)[cH:28]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 923Sodium Ion2회HCID 1140TolueneHCID 19660Carbonate IonHCID 27343864-(Trifluoromethoxy)phenylboronic acidHCID 24988884HCID 24988884, 화합물HCID 178420554HCID 178420554, 화합물

생성물 1

HCID 59738189
HCID 59738189, 화합물

출처 및 근거

ORD 기록
ord-ea1c0a4918cf47b08a8f8f1d8a1d44d4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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