Acetic Acid → HCID 43461694, compound
Reaction equation
[C:11]([O:12][BH-:13]([O:14][C:15](=[O:16])[CH3:17])[O:18][C:19](=[O:20])[CH3:21])(=[O:22])[CH3:23].[CH3:25][C:26](=[O:27])[OH:28].[CH3:29][N:30]1[CH2:31][CH2:32][C:33](=[O:36])[CH2:34][CH2:35]1.[Cl:37][CH2:38][Cl:39].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([NH2:7])[cH:8][cH:9][cH:10]1.[Na+:24]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([NH:7][CH:33]2[CH2:32][CH2:31][N:30]([CH3:29])[CH2:35][CH2:34]2)[cH:8][cH:9][cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-9ce7a27dce6a405a84d36f21bf3509a7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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