Acetic Acid → HCID 91047970, compound
Reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[C:7](=[O:8])([CH3:9])[O:10][CH:11]1[C:12]([CH3:53])([O:54][CH:55]([CH3:56])[O:57][CH2:58][CH3:59])[CH2:13][CH2:14][CH:15]([O:47][CH:48]([CH3:49])[O:50][CH2:51][CH3:52])[CH2:16][C:17](=[O:18])[O:19][CH:20]([C:25](=[CH:26][CH:27]=[CH:28][CH:29]([CH2:30][CH:31]2[CH:32]([CH:33]([CH:34]([CH2:35][CH3:36])[O:37][CH:38]([CH3:39])[O:40][CH2:41][CH3:42])[CH3:43])[O:44]2)[CH3:45])[CH3:46])[CH:21]([CH3:24])[CH:22]=[CH:23]1.[CH3:60][C:61](=[O:62])[OH:63].[CH3:64][CH2:65][O:66][C:67](=[O:68])[CH3:69].[CH3:70][OH:71].[K+:5].[K+:6].[OH2:72]>>[OH:10][CH:11]1[C:12]([CH3:53])([O:54][CH:55]([CH3:56])[O:57][CH2:58][CH3:59])[CH2:13][CH2:14][CH:15]([O:47][CH:48]([CH3:49])[O:50][CH2:51][CH3:52])[CH2:16][C:17](=[O:18])[O:19][CH:20]([C:25](=[CH:26][CH:27]=[CH:28][CH:29]([CH2:30][CH:31]2[CH:32]([CH:33]([CH:34]([CH2:35][CH3:36])[O:37][CH:38]([CH3:39])[O:40][CH2:41][CH3:42])[CH3:43])[O:44]2)[CH3:45])[CH3:46])[CH:21]([CH3:24])[CH:22]=[CH:23]1Participants
8
Sources & evidence
- ORD record
- ord-8204735b95cd40b1a8474e1356f5083f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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