Acetic Acid → HCID 178514248, compound
Reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][OH:33].[CH3:5][O:6][C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][C:14]([NH:15][C:16]12[CH2:17][CH:18]3[CH2:19][CH:20]([CH2:21][CH:22]([CH2:23]1)[CH2:24]3)[CH2:25]2)=[O:26])=[O:27].[ClH:1].[NH2:2][OH:3].[Na:4].[OH2:34]>>[NH-:2][OH:3].[O:6]=[C:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][C:14]([NH:15][C:16]12[CH2:17][CH:18]3[CH2:19][CH:20]([CH2:21][CH:22]([CH2:23]1)[CH2:24]3)[CH2:25]2)=[O:26])[OH:27]Participants
9
Sources & evidence
- ORD record
- ord-ba2d81be2f8f48428c975c2fb47d05db
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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