Ethanol → HCID 21948178, compound

HRID 200931Notes

Reaction equation

HRID 200931 reaction equation
[CH2:1]([CH:2]=[CH2:3])[NH:4][c:5]1[cH:6][c:7]([CH3:29])[c:8]2[c:9](=[O:28])[cH:10][c:11]([NH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[n:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:13]2[n:14]1.[CH3:30][S:31]([OH:32])(=[O:33])=[O:34].[CH3:35][CH2:36][OH:37].[CH3:38][CH2:39][O:40][C:41]([CH3:42])=[O:43]>>[NH2:4][c:5]1[cH:6][c:7]([CH3:29])[c:8]2[c:9](=[O:28])[cH:10][c:11]([NH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][cH:27]3)[n:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[c:13]2[n:14]1

Participants

5

Reactant 4

HCID 702EthanolHCID 6395Methanesulfonic AcidHCID 8857Ethyl AcetateHCID 21948171HCID 21948171, compound

Product 1

HCID 21948178HCID 21948178, compound

Sources & evidence

ORD record
ord-79314fbda09e48adb8b54c319c81e76a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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