Water → HCID 23598709, compound

HRID 1239044Notes

Reaction equation

HRID 1239044 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][CH2:9][C:10]1=[CH:11][CH2:12][CH:13]([NH:31][C:32](=[O:33])[c:34]2[n:35][cH:36][cH:37][c:38]3[cH:39][cH:40][cH:41][cH:42][c:43]23)[C:14](=[O:30])[N:15]([CH2:17][C:18]([NH:19][CH:20]2[CH:21]([O:26][CH2:27][CH3:28])[O:22][C:23](=[O:25])[CH2:24]2)=[O:29])[CH2:16]1.[CH3:51][C:52]#[N:53].[F:44][C:45]([F:46])([F:47])[C:48]([OH:49])=[O:50].[OH2:54]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][CH2:9][C:10]1=[CH:11][CH2:12][CH:13]([NH:31][C:32](=[O:33])[c:34]2[n:35][cH:36][cH:37][c:38]3[cH:39][cH:40][cH:41][cH:42][c:43]23)[C:14](=[O:30])[N:15]([CH2:17][C:18]([NH:19][CH:20]2[CH:21]([OH:26])[O:22][C:23](=[O:25])[CH2:24]2)=[O:29])[CH2:16]1

Participants

5

Reactant 4

HCID 962WaterHCID 6342AcetonitrileHCID 6422Trifluoroacetic acidHCID 23598708HCID 23598708, compound

Product 1

HCID 23598709HCID 23598709, compound

Sources & evidence

ORD record
ord-191aadf1a5404d3792ee9bdd53fff6c6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…