Acetate → HCID 22218329, compound
Reaction equation
[C:69](=[O:70])([O-:71])[O-:72].[CH3:1][c:2]1[c:3]([O:15][S:16]([C:17]([F:18])([F:19])[F:20])(=[O:21])=[O:22])[cH:4][c:5]2[c:10]([cH:11]1)[C:9]([CH3:12])=[CH:8][CH2:7][C:6]2([CH3:13])[CH3:14].[CH3:75][CH2:76][O:77][C:78](=[O:79])[c:80]1[cH:81][cH:82][c:83]([NH2:84])[cH:85][cH:86]1.[CH3:96][c:97]1[cH:98][cH:99][cH:100][cH:101][cH:102]1.[Cs+:73].[Cs+:74].[O-:88][C:89]([CH3:90])=[O:91].[O-:92][C:93]([CH3:94])=[O:95].[Pd+2:87].[cH:23]1[cH:24][cH:25][c:26]([P:27]([c:28]2[cH:29][cH:30][c:31]3[c:32]([cH:33][cH:34][cH:35][cH:36]3)[c:37]2-[c:38]2[c:39]3[c:40]([cH:41][cH:42][cH:43][cH:44]3)[cH:45][cH:46][c:47]2[P:48]([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:67][cH:68]1>>[CH3:1][c:2]1[c:3]([NH:84][c:83]2[cH:82][cH:81][c:80]([C:78]([O:77][CH2:76][CH3:75])=[O:79])[cH:86][cH:85]2)[cH:4][c:5]2[c:10]([cH:11]1)[C:9]([CH3:12])=[CH:8][CH2:7][C:6]2([CH3:13])[CH3:14]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-2b10959a4d774707b010c5998fd94ad5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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