Acetic Acid → HCID 178495277, compound

HRID 2345291Notes

Reaction equation

HRID 2345291 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([C:17](=[O:18])[N:19]([CH:20]2[CH2:21][N:22]([C:35](=[O:36])[O:37][CH2:38][c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:23][CH:24]([NH:26][C:27]([O:28][CH2:29][C:30]([Cl:31])([Cl:32])[Cl:33])=[O:34])[CH2:25]2)[CH2:45][CH:46]([CH3:47])[CH3:48])[c:9]([NH:11][CH2:12][CH2:13][CH2:14][O:15][CH3:16])[n:10]1.[CH3:49][C:50](=[O:51])[OH:52].[Cu:53].[Zn:54]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([C:17](=[O:18])[N:19]([CH:20]2[CH2:21][N:22]([C:35](=[O:36])[O:37][CH2:38][c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:23][CH:24]([NH2:26])[CH2:25]2)[CH2:45][CH:46]([CH3:47])[CH3:48])[c:9]([NH:11][CH2:12][CH2:13][CH2:14][O:15][CH3:16])[n:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 23978CopperHCID 23994ZincHCID 178495278HCID 178495278, compound

Product 1

HCID 178495277HCID 178495277, compound

Sources & evidence

ORD record
ord-87dee147bf2f4c6182015bf1e8110314
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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