Acetic Acid → HCID 49857274, compound

HRID 214042Notes

Reaction equation

HRID 214042 reaction equation
[C:34]([OH:35])(=[O:36])[CH3:37].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[nH:8][c:9]3[c:10](-[c:18]4[cH:19][cH:20][c:21]([N+:31]([O-:32])=[O:33])[c:22]5[c:23]4[s:24][c:25]4[c:26]5[cH:27][cH:28][cH:29][cH:30]4)[cH:11][cH:12][cH:13][c:14]3[c:15](=[O:17])[cH:16]2)[CH2:5][CH2:6]1.[Zn:38]>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[nH:8][c:9]3[c:10](-[c:18]4[cH:19][cH:20][c:21]([NH2:31])[c:22]5[c:23]4[s:24][c:25]4[c:26]5[cH:27][cH:28][cH:29][cH:30]4)[cH:11][cH:12][cH:13][c:14]3[c:15](=[O:17])[cH:16]2)[CH2:5][CH2:6]1

Participants

4

Sources & evidence

ORD record
ord-ab4c378ebbca4654a7c8cafcfbc01d4c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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