Acetic Acid → Acetic Acid

HRID 1570361Notes

Reaction equation

HRID 1570361 reaction equation
[C:49]([CH3:50])(=[O:51])[OH:52].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([NH:11][c:12]1[cH:13][cH:14][c:15]([C:18]([NH:19][OH:20])=[NH:21])[cH:16][cH:17]1)[c:22]1[c:23]([NH:38][S:39](=[O:40])(=[O:41])[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:24][c:25]([O:30][CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:26]([O:28][CH3:29])[cH:27]1)=[O:48].[CH3:53][OH:54]>>[C:49]([CH3:50])(=[O:51])[OH:52].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][C:9]([CH:10]([NH:11][c:12]1[cH:13][cH:14][c:15]([C:18](=[NH:19])[NH2:21])[cH:16][cH:17]1)[c:22]1[c:23]([NH:38][S:39](=[O:40])(=[O:41])[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[cH:24][c:25]([O:30][CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[c:26]([O:28][CH3:29])[cH:27]1)=[O:48]

Participants

5

Reactant 3

HCID 176Acetic AcidHCID 887MethanolHCID 178492116HCID 178492116, compound

Product 2

HCID 176Acetic AcidHCID 15410793HCID 15410793, compound

Sources & evidence

ORD record
ord-69de46060c68461fa438865c2876697f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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