Hydrochloric Acid → HCID 69130265, compound

HRID 680906Notes

Reaction equation

HRID 680906 reaction equation
[CH3:11][O:12][c:13]1[cH:14][c:15]([CH:21]=[C:22]([C:23](=[O:24])[OH:25])[c:26]2[cH:27][cH:28][c:29]([O:32][c:33]3[cH:34][cH:35][c:36]([CH2:39][CH2:40][C:41](=[O:42])[O:43][CH2:44][CH3:45])[cH:37][cH:38]3)[cH:30][cH:31]2)[cH:16][c:17]([O:19][CH3:20])[cH:18]1.[CH3:55][CH2:56][O-:57].[CH3:58][CH2:59][OH:60].[CH:1]1([NH:7][C:8](=[O:9])[NH2:10])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:53].[F:46][C:47]([F:48])([F:49])[C:50]([OH:51])=[O:52].[Na+:54]>>[CH:1]1([NH:7][C:8](=[O:9])[NH:10][C:41]([CH2:40][CH2:39][c:36]2[cH:35][cH:34][c:33]([O:32][c:29]3[cH:28][cH:27][c:26]([C:22](=[CH:21][c:15]4[cH:14][c:13]([O:12][CH3:11])[cH:18][c:17]([O:19][CH3:20])[cH:16]4)[C:23](=[O:24])[OH:25])[cH:31][cH:30]3)[cH:38][cH:37]2)=[O:42])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 6422Trifluoroacetic acidHCID 69684CyclohexylureaHCID 1194401-Hydroxyethyl radicalHCID 69131096HCID 69131096, compound

Product 1

HCID 69130265HCID 69130265, compound

Sources & evidence

ORD record
ord-83dc3413ecb5450bbe868a7eb159d609
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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