Acetic Acid → Isopropyl 4-(1-hydroxy-1-methylethyl)-2-isopropoxymethyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

HRID 702550

Reaction equation

HRID 702550 reaction equation
[C:62]([OH:63])([c:64]1[cH:65][cH:66][cH:67][cH:68][cH:69]1)([c:70]1[cH:71][cH:72][cH:73][cH:74][cH:75]1)[c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1.[CH3:58][C:59](=[O:60])[OH:61].[OH2:82].[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:53][O:54][CH:55]([CH3:56])[CH3:57])[n:8]([CH2:16][c:17]2[cH:18][cH:19][c:20](-[c:23]3[c:24](-[c:29]4[n:30][n:31][n:32][n:33]4[C:34]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)([c:41]4[cH:42][cH:43][cH:44][cH:45][cH:46]4)[c:47]4[cH:48][cH:49][cH:50][cH:51][cH:52]4)[cH:25][cH:26][cH:27][cH:28]3)[cH:21][cH:22]2)[c:9]1[C:10](=[O:11])[O:12][CH:13]([CH3:14])[CH3:15]>>[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH2:53][O:54][CH:55]([CH3:56])[CH3:57])[n:8]([CH2:16][c:17]2[cH:18][cH:19][c:20](-[c:23]3[c:24](-[c:29]4[n:30][n:31][n:32][nH:33]4)[cH:25][cH:26][cH:27][cH:28]3)[cH:21][cH:22]2)[c:9]1[C:10](=[O:11])[O:12][CH:13]([CH3:14])[CH3:15]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 6457TriphenylcarbinolHCID 19036290Isopropyl 4-(1-hydroxy-1-methylethyl)-2-isopropoxymethyl-1-{4-[2-(trityltetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

Product 1

HCID 178459022Isopropyl 4-(1-hydroxy-1-methylethyl)-2-isopropoxymethyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate

Sources & evidence

ORD record
ord-6dd4ce461d9e43b78079982175bb0328
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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