Acetic Acid → HCID 178491587, compound
Reaction equation
[C:1]([O:2][BH-:3]([O:4][C:5](=[O:6])[CH3:7])[O:8][C:9](=[O:10])[CH3:11])(=[O:12])[CH3:13].[CH3:31][O:32][c:33]1[cH:34][c:35]([C:36](=[O:37])[NH:38][c:39]2[cH:40][cH:41][c:42]([N:45]3[CH2:46][CH2:47][C:48](=[O:51])[CH2:49][CH2:50]3)[cH:43][cH:44]2)[cH:52][cH:53][c:54]1[O:55][CH3:56].[CH3:57][C:58](=[O:59])[OH:60].[NH2:15][CH2:16][CH:17]([CH2:18][O:19][c:20]1[cH:21][cH:22][cH:23][c:24]2[nH:25][c:26](=[O:29])[nH:27][c:28]12)[OH:30].[Na+:14]>>[NH:15]([CH2:16][CH:17]([CH2:18][O:19][c:20]1[cH:21][cH:22][cH:23][c:24]2[nH:25][c:26](=[O:29])[nH:27][c:28]12)[OH:30])[CH:48]1[CH2:47][CH2:46][N:45]([c:42]2[cH:41][cH:40][c:39]([NH:38][C:36]([c:35]3[cH:34][c:33]([O:32][CH3:31])[c:54]([O:55][CH3:56])[cH:53][cH:52]3)=[O:37])[cH:44][cH:43]2)[CH2:50][CH2:49]1Participants
6
Sources & evidence
- ORD record
- ord-f2d1316ca2f34e86863b1eb12f592ff5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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