Acetic Acid → HCID 136054475, compound

HRID 2321017Notes

Reaction equation

HRID 2321017 reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:38][C:39]([OH:40])=[O:41].[CH3:42][C:43]([O:44][C:45](=[O:46])[CH3:47])=[O:48].[OH:1][NH:2][CH:3]([CH2:4][S:5](=[O:6])(=[O:7])[c:8]1[cH:9][cH:10][c:11](-[c:14]2[cH:15][c:16]([CH2:20][NH:21][C:22](=[O:23])[c:24]3[n:25][c:26]4[cH:27][cH:28][cH:29][cH:30][c:31]4[c:32](=[O:34])[nH:33]3)[cH:17][cH:18][cH:19]2)[cH:12][cH:13]1)[CH:35]([CH3:36])[CH3:37]>>[OH:1][N:2]([CH:3]([CH2:4][S:5](=[O:6])(=[O:7])[c:8]1[cH:9][cH:10][c:11](-[c:14]2[cH:15][c:16]([CH2:20][NH:21][C:22](=[O:23])[c:24]3[n:25][c:26]4[cH:27][cH:28][cH:29][cH:30][c:31]4[c:32](=[O:34])[nH:33]3)[cH:17][cH:18][cH:19]2)[cH:12][cH:13]1)[CH:35]([CH3:36])[CH3:37])[C:39]([CH3:38])=[O:40]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 7918Acetic AnhydrideHCID 8028TetrahydrofuranHCID 136054509HCID 136054509, compound

Product 1

HCID 136054475HCID 136054475, compound

Sources & evidence

ORD record
ord-9acbe87069344efe960497d207a20470
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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