Acetic Acid → HCID 178437100, compound

HRID 191981Notes

Reaction equation

HRID 191981 reaction equation
[CH2:1]([CH3:2])[c:3]1[cH:4][n:5]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[n:28][n:29][n:30][n:31]4[C:32]([c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[n:6]2[n:7][c:8]([CH:11]([CH3:12])[CH3:13])[n:9][c:10]12.[CH3:51][OH:52].[CH3:53][C:54](=[O:55])[OH:56]>>[CH2:1]([CH3:2])[c:3]1[cH:4][n:5]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[nH:28][n:29][n:30][n:31]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[n:6]2[n:7][c:8]([CH:11]([CH3:12])[CH3:13])[n:9][c:10]12

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 887MethanolHCID 10604331HCID 10604331, compound

Product 1

HCID 178437100HCID 178437100, compound

Sources & evidence

ORD record
ord-4854ae43b35e474b8cfe7c39f8fa771f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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