Water → HCID 178523195, compound

HRID 198969Notes

Reaction equation

HRID 198969 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([NH:8][C:9](=[O:10])[O:11][CH2:12][CH:13]1[c:14]2[c:15]3[c:16]([c:17]4[c:18]([c:19]2-[c:20]2[c:21]5[c:22]([c:23]6[c:24]([c:25]21)[cH:26][cH:27][cH:28][cH:29]6)[cH:30][cH:31][cH:32][cH:33]5)[cH:34][cH:35][cH:36][cH:37]4)[cH:38][cH:39][cH:40][cH:41]3)[CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)=[O:49].[CH3:50][CH2:51][O:52][CH2:53][CH3:54].[OH2:62].[OH:55][C:56]([C:57]([F:58])([F:59])[F:60])=[O:61]>>[O:5]=[C:6]([CH:7]([NH:8][C:9](=[O:10])[O:11][CH2:12][CH:13]1[c:14]2[c:15]3[c:16]([c:17]4[c:18]([c:19]2-[c:20]2[c:21]5[c:22]([c:23]6[c:24]([c:25]21)[cH:26][cH:27][cH:28][cH:29]6)[cH:30][cH:31][cH:32][cH:33]5)[cH:34][cH:35][cH:36][cH:37]4)[cH:38][cH:39][cH:40][cH:41]3)[CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1)[OH:49]

Participants

5

Reactant 4

HCID 962WaterHCID 3283Diethyl EtherHCID 6422Trifluoroacetic acidHCID 178450912HCID 178450912, compound

Product 1

HCID 178523195HCID 178523195, compound

Sources & evidence

ORD record
ord-c1fcdd47586f4fb292fc2c81ef9f58b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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