Ethanol → HCID 18761363, compound
Reaction equation
[Br:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH:9]([CH2:33][O:34][CH2:35][c:36]3[c:37]([F:44])[cH:38][c:39]([F:43])[c:40]([F:42])[cH:41]3)[CH2:10][CH:11]([S:13][C:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[CH2:12]2)[n:6][cH:7]1.[C:54](=[O:55])([O-:56])[O-:57].[CH2:60]([CH2:61][O:62][CH3:63])[O:64][CH3:65].[CH3:66][CH2:67][OH:68].[Na+:58].[Na+:59].[OH:45][B:46]([OH:47])[c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[cH:69]1[cH:70][cH:71][c:72]([P:73]([Pd:74]([P:75]([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)([c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([P:94]([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)([c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)[c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[P:113]([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)([c:132]2[cH:133][cH:134][cH:135][cH:136][cH:137]2)[c:138]2[cH:139][cH:140][cH:141][cH:142][cH:143]2)[cH:144][cH:145]1>>[c:2]1(-[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:3][n:4][c:5]([N:8]2[CH:9]([CH2:33][O:34][CH2:35][c:36]3[c:37]([F:44])[cH:38][c:39]([F:43])[c:40]([F:42])[cH:41]3)[CH2:10][CH:11]([S:13][C:14]([c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[CH2:12]2)[n:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-fe9aac3f55024312b05769b43226b1f1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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