Water → HCID 58102913, compound

HRID 200243Notes

Reaction equation

HRID 200243 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8]([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)[c:9]([CH2:11][CH2:12][CH3:13])[cH:10]1.[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[OH2:56]>>[O:3]=[C:4]([OH:5])[c:6]1[n:7][n:8]([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)[c:9]([CH2:11][CH2:12][CH3:13])[cH:10]1

Participants

4

Reactant 3

HCID 962WaterHCID 8028TetrahydrofuranHCID 667577635-Propyl-1-[2'-(1-trityl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-1H-pyrazole-3-carboxylic acid ethyl ester

Product 1

HCID 58102913HCID 58102913, compound

Sources & evidence

ORD record
ord-0588554e99ab4fafb3080fcf14be2dcc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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