Acetate → HCID 178493163, compound
Reaction equation
[C:40](=[O:41])([O-:42])[O-:43].[CH3:16][C:17](=[O:18])[O-:19].[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8]([CH3:13])[c:9]([Br:12])[cH:10][cH:11]1)[CH3:14].[CH3:20][O:21][c:22]1[cH:23][c:24]([CH2:28][CH2:29][c:30]2[n:31][c:32]3[c:33]([n:34][cH:35][c:36]([I:38])[cH:37]3)[nH:39]2)[n:25][cH:26][cH:27]1.[Cl-:47].[K+:15].[K+:44].[K+:45].[Li+:46].[O:48]1[CH2:49][CH2:50][O:51][CH2:52][CH2:53]1.[OH2:54].[Pd:55].[c:113]1([P:114]([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[cH:127][cH:128][cH:129][cH:130][cH:131]1.[c:56]1([P:57]([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71][cH:72][cH:73][cH:74]1.[c:75]1([P:76]([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[cH:89][cH:90][cH:91][cH:92][cH:93]1.[c:94]1([P:95]([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[cH:108][cH:109][cH:110][cH:111][cH:112]1>>[CH3:1][N:2]([S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8]([CH3:13])[c:9](-[c:36]2[cH:35][n:34][c:33]3[c:32]([n:31][c:30]([CH2:29][CH2:28][c:24]4[cH:23][c:22]([O:21][CH3:20])[cH:27][cH:26][n:25]4)[nH:39]3)[cH:37]2)[cH:10][cH:11]1)[CH3:14]Participants
12
Reactant 11
Product 1
Sources & evidence
- ORD record
- ord-d3bb8119045c4e4384975e142a77a30e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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