3-Acetylthio-2-methoxycarbonylmethylpropanoic acid → HCID 178477082, compound

HRID 1561797Notes

Reaction equation

HRID 1561797 reaction equation
[C:14]([S:15][CH2:16][CH:17]([CH2:18][C:19]([O:20][CH3:21])=[O:22])[C:23]([OH:24])=[O:25])(=[O:26])[CH3:27].[C:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]([C:7](=[O:8])[OH:9])[CH2:10][C:11]([NH2:12])=[O:13].[C:28]([CH2:29][CH:30]([CH2:31][S:32][C:33](=[O:42])[CH3:43])[CH2:44][N:34]1[CH:35]([C:36](=[O:37])[OH:38])[CH2:39][CH2:40][CH2:41]1)(=[O:45])[NH2:46]>>[C:1]([CH3:2])(=[O:3])[S:4][CH2:5][CH:6]([C:7](=[O:9])[N:34]1[CH:35]([C:36](=[O:37])[OH:38])[CH2:39][CH2:40][CH2:41]1)[CH2:10][C:11]([NH2:12])=[O:13]

Participants

4

Reactant 3

HCID 127744283-Acetylthio-2-methoxycarbonylmethylpropanoic acidHCID 203444533-Acetylthio-2-carbamoylmethylpropanoic acidHCID 178477081HCID 178477081, compound

Product 1

HCID 178477082HCID 178477082, compound

Sources & evidence

ORD record
ord-41cd5c58f82a4d5a9420feee58cda11a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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