Ethanolamine → HCID 69203581, compound

HRID 1117159Notes

Reaction equation

HRID 1117159 reaction equation
[CH3:77][CH2:78][O:79][C:80](=[O:81])[CH3:82].[CH:63]([N:64]([CH2:65][CH3:66])[CH:67]([CH3:68])[CH3:69])([CH3:70])[CH3:71].[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[OH:25][CH2:26][CH2:27][NH2:28].[OH:53][n:54]1[c:55]2[c:56]([cH:57][cH:58][cH:59][cH:60]2)[n:61][n:62]1.[P-:29]([F:30])([F:31])([F:32])([F:33])([F:34])[F:35].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[n:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1.[o:1]1[cH:2][c:3]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]([CH3:24])[c:13](-[c:15]3[cH:16][cH:17][c:18]([C:21](=[O:22])[OH:23])[cH:19][cH:20]3)[cH:14]2)[cH:4][cH:5]1>>[o:1]1[cH:2][c:3]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]([CH3:24])[c:13](-[c:15]3[cH:16][cH:17][c:18]([C:21](=[O:23])[NH:28][CH2:27][CH2:26][OH:25])[cH:19][cH:20]3)[cH:14]2)[cH:4][cH:5]1

Participants

9

Reactant 8

HCID 700EthanolamineHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 757711-HydroxybenzotriazoleHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 691521465'-(3-Furoylamino)-2'-methyl-1,1'-biphenyl-4-carboxylic acid

Product 1

HCID 69203581HCID 69203581, compound

Sources & evidence

ORD record
ord-723608e716844006a2e88b360d5b098d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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