Acetic Acid → HCID 178437627, compound

HRID 2162750Notes

Reaction equation

HRID 2162750 reaction equation
[CH2:1]([CH3:2])[c:3]1[n:4]([CH2:23][c:24]2[cH:25][cH:26][c:27](-[c:30]3[c:31](-[c:36]4[n:37][n:38][n:39][n:40]4[C:41]([c:42]4[cH:43][cH:44][cH:45][cH:46][cH:47]4)([c:48]4[cH:49][cH:50][cH:51][cH:52][cH:53]4)[c:54]4[cH:55][cH:56][cH:57][cH:58][cH:59]4)[cH:32][cH:33][cH:34][cH:35]3)[cH:28][cH:29]2)[c:5]([C:12](=[O:13])[O:14][CH2:15][c:16]2[o:17][c:18](=[O:22])[o:19][c:20]2[CH3:21])[c:6]([C:8]([CH3:9])([CH3:10])[OH:11])[n:7]1.[CH3:60][C:61](=[O:62])[OH:63]>>[CH2:1]([CH3:2])[c:3]1[n:4]([CH2:23][c:24]2[cH:25][cH:26][c:27](-[c:30]3[c:31](-[c:36]4[n:37][n:38][n:39][nH:40]4)[cH:32][cH:33][cH:34][cH:35]3)[cH:28][cH:29]2)[c:5]([C:12](=[O:13])[O:14][CH2:15][c:16]2[o:17][c:18](=[O:22])[o:19][c:20]2[CH3:21])[c:6]([C:8]([CH3:9])([CH3:10])[OH:11])[n:7]1

Participants

3

Reactant 2

HCID 176Acetic AcidHCID 19036185(5-Methyl-2-oxo-1,3-dioxolen-4-yl)methyl 2-ethyl-4-(1-hydroxy-1-methylethyl)-1-{4-[2-(trityltetrazole-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

Product 1

HCID 178437627HCID 178437627, compound

Sources & evidence

ORD record
ord-9776086c0de84526bcc8ca2abcd33f48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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