Ethanolamine → HCID 68758576, compound

HRID 210934Notes

Reaction equation

HRID 210934 reaction equation
[CH3:82][OH:83].[NH2:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[cH:10][c:11]([NH:28][c:29]3[n:30][c:31]([Br:35])[cH:32][cH:33][cH:34]3)[c:12]3[n:13]([n:14]2)[c:15]([C:18](=[O:19])[NH:20][c:21]2[c:22]([F:27])[cH:23][n:24][cH:25][cH:26]2)[cH:16][n:17]3)[CH2:6][CH2:7]1.[NH2:36][CH2:37][CH2:38][OH:39].[NH2:40][CH:41]1[CH2:42][CH2:43][CH:44]([NH:45][c:46]2[cH:47][c:48]([NH:49][c:50]3[cH:51][cH:52][cH:53][c:54]([NH:55][CH:56]4[CH2:57][CH2:58][CH:59]([OH:60])[CH2:61][CH2:62]4)[n:63]3)[c:64]3[n:65]([c:66]([C:67]([NH:68][c:69]4[cH:70][cH:71][n:72][cH:73][c:74]4[F:75])=[O:76])[cH:77][n:78]3)[n:79]2)[CH2:80][CH2:81]1>>[NH2:1][CH:2]1[CH2:3][CH2:4][CH:5]([NH:8][c:9]2[cH:10][c:11]([NH:28][c:29]3[n:30][c:31]([NH:36][CH2:37][CH2:38][OH:39])[cH:32][cH:33][cH:34]3)[c:12]3[n:13]([n:14]2)[c:15]([C:18](=[O:19])[NH:20][c:21]2[c:22]([F:27])[cH:23][n:24][cH:25][cH:26]2)[cH:16][n:17]3)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 700EthanolamineHCID 887MethanolHCID 59624607HCID 59624607, compoundHCID 68760926HCID 68760926, compound

Product 1

HCID 68758576HCID 68758576, compound

Sources & evidence

ORD record
ord-cb63a468f2d1402d984bdae05e5cdcca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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