Acetic Acid → HCID 178517221, compound
Reaction equation
[CH3:27][C:28](=[O:29])[OH:30].[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[O:12].[NH:13]([NH2:14])[S:15](=[O:16])(=[O:17])[c:18]1[cH:19][c:20]([C:21](=[O:22])[OH:23])[cH:24][cH:25][cH:26]1>>[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[NH:7][C:6](=[O:11])[C:5]2=[N:14][NH:13][S:15](=[O:16])(=[O:17])[c:18]1[cH:19][c:20]([C:21](=[O:22])[OH:23])[cH:24][cH:25][cH:26]1Participants
4
Sources & evidence
- ORD record
- ord-9ba43131ad9341be90a064d6d6433105
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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