Acetic Acid → HCID 23277624, compound
Reaction equation
[CH3:44][C:45](=[O:46])[O:47][C:48](=[O:49])[CH3:50].[CH3:57][C:58](=[O:59])[OH:60].[NH2:1][c:2]1[cH:3][c:4]([CH3:43])[c:5]([OH:42])[c:6]([C:7](=[O:8])[OH:9])[c:10]1[CH2:11][CH2:12][CH:13]([CH:14]([CH:15]([C:16]([CH:17]([CH:18]1[O:19][C:20]([CH:24]2[O:25][CH:26]([CH3:33])[C:27]([OH:30])([CH2:31][CH3:32])[CH2:28][CH2:29]2)([CH2:34][CH3:35])[CH2:21][CH:22]1[CH3:23])[CH2:36][CH3:37])=[O:38])[CH3:39])[OH:40])[CH3:41].[Na+:51].[Na+:52].[O-:53][C:54](=[O:55])[O-:56]>>[NH:1]([c:2]1[cH:3][c:4]([CH3:43])[c:5]([OH:42])[c:6]([C:7](=[O:8])[OH:9])[c:10]1[CH2:11][CH2:12][CH:13]([CH:14]([CH:15]([C:16]([CH:17]([CH:18]1[O:19][C:20]([CH:24]2[O:25][CH:26]([CH3:33])[C:27]([OH:30])([CH2:31][CH3:32])[CH2:28][CH2:29]2)([CH2:34][CH3:35])[CH2:21][CH:22]1[CH3:23])[CH2:36][CH3:37])=[O:38])[CH3:39])[OH:40])[CH3:41])[C:45]([CH3:44])=[O:46]Participants
6
Sources & evidence
- ORD record
- ord-9690ba65b05c489b8e3019179ef2c08d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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