Acetic Acid → HCID 22411080, compound

HRID 1121053Notes

Reaction equation

HRID 1121053 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH2:10][CH2:11][CH:12]([NH:13][C:14]([CH:15]([NH:16][C:17]([CH2:18][O:19][CH2:20][CH2:21][N:22]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27])=[O:33])[CH3:34])=[O:35])[C:36]([NH2:37])=[O:38])=[O:39].[CH3:42][C:43](=[O:44])[OH:45].[H:40][H:41]>>[O:8]=[C:9]([CH2:10][CH2:11][CH:12]([NH:13][C:14]([CH:15]([NH:16][C:17]([CH2:18][O:19][CH2:20][CH2:21][N:22]1[C:23](=[O:32])[c:24]2[c:25]([cH:28][cH:29][cH:30][cH:31]2)[C:26]1=[O:27])=[O:33])[CH3:34])=[O:35])[C:36]([NH2:37])=[O:38])[OH:39]

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 178418361HCID 178418361, compoundHCID 178465248HCID 178465248, compound

Product 1

HCID 22411080HCID 22411080, compound

Sources & evidence

ORD record
ord-5ddc18de13ff4dab9cc0080544b9aea6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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