Acetic Acid → HCID 178467658, compound

HRID 1560099Notes

Reaction equation

[CH2:1]([CH3:2])[O:3][CH2:4][c:5]1[n:6]([CH2:25][c:26]2[cH:27][cH:28][c:29](-[c:32]3[c:33](-[c:38]4[n:39][n:40][n:41][n:42]4[C:43]([c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)([c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[c:56]4[cH:57][cH:58][cH:59][cH:60][cH:61]4)[cH:34][cH:35][cH:36][cH:37]3)[cH:30][cH:31]2)[c:7]([C:14](=[O:15])[O:16][CH2:17][c:18]2[o:19][c:20](=[O:24])[o:21][c:22]2[CH3:23])[c:8]([C:10]([CH3:11])([CH3:12])[OH:13])[n:9]1.[CH3:62][C:63](=[O:64])[OH:65]>>[CH2:1]([CH3:2])[O:3][CH2:4][c:5]1[n:6]([CH2:25][c:26]2[cH:27][cH:28][c:29](-[c:32]3[c:33](-[c:38]4[n:39][n:40][n:41][nH:42]4)[cH:34][cH:35][cH:36][cH:37]3)[cH:30][cH:31]2)[c:7]([C:14](=[O:15])[O:16][CH2:17][c:18]2[o:19][c:20](=[O:24])[o:21][c:22]2[CH3:23])[c:8]([C:10]([CH3:11])([CH3:12])[OH:13])[n:9]1

Participants

Reactant 2

HCID 176Acetic Acid

HCID 19036259(5-Methyl-2-oxo-1,3-dioxolen-4-yl)methyl 2-ethoxymethyl-4-(1-hydroxy-1-methylethyl)-1-{4-[2-(trityltetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

Product 1

HCID 178467658HCID 178467658, compound

Sources & evidence

ORD record: ord-02e4983584b94ebebb2710845f21291d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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