Acetic Acid → HCID 22246119, compound

HRID 2157582Notes

Reaction equation

HRID 2157582 reaction equation
[CH3:35][C:36](=[O:37])[OH:38].[CH3:41][OH:42].[H:39][H:40].[c:1]1([CH2:2][O:3][C:4](=[O:5])[NH:11][CH2:12][CH2:13][c:14]2[o:15][c:16](-[c:25]3[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[NH2:34])[cH:29][cH:30]3)[c:17](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[n:18]2)[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[NH2:11][CH2:12][CH2:13][c:14]1[o:15][c:16](-[c:25]2[cH:26][cH:27][c:28]([S:31](=[O:32])(=[O:33])[NH2:34])[cH:29][cH:30]2)[c:17](-[c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[n:18]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 22246130HCID 22246130, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 22246119HCID 22246119, compound

Sources & evidence

ORD record
ord-12adcd01f72948898cb2b05baa07c6a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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