Acetate → HCID 69006468, compound
Reaction equation
[C:44](#[N:45])[CH2:46][C:47](=[O:48])[OH:49].[CH3:1][n:2]1[c:3](-[c:14]2[cH:15][c:16]3[c:24]([cH:25][cH:26]2)-[c:23]2[c:18]([cH:19][c:20]([N:27]([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:21][cH:22]2)[C:17]3([CH2:40][CH3:41])[CH2:42][CH3:43])[cH:4][cH:5][c:6]1-[c:7]1[cH:8][cH:9][c:10]([CH:12]=[O:13])[s:11]1.[CH3:50][C:51](=[O:52])[OH:53].[CH3:55][C:56](=[O:57])[O-:58].[NH4+:54]>>[CH3:1][n:2]1[c:3](-[c:14]2[cH:15][c:16]3[c:24]([cH:25][cH:26]2)-[c:23]2[c:18]([cH:19][c:20]([N:27]([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[cH:21][cH:22]2)[C:17]3([CH2:40][CH3:41])[CH2:42][CH3:43])[cH:4][cH:5][c:6]1-[c:7]1[cH:8][cH:9][c:10]([CH:12]=[C:46]([C:44]#[N:45])[C:47](=[O:48])[OH:49])[s:11]1Participants
6
Sources & evidence
- ORD record
- ord-5a69fce8ded54401b7b7796fff3c6fdb
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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