Hydrochloric Acid → HCID 54713197, compound

HRID 1238701Notes

Reaction equation

HRID 1238701 reaction equation
[ClH:24].[K+:48].[K+:49].[NH2:25][c:26]1[cH:27][c:28]([C:44]([CH3:45])([CH3:46])[CH3:47])[c:29]([S:33][S:34]([c:35]2[cH:36][cH:37][c:38]([CH3:39])[cH:40][cH:41]2)(=[O:42])=[O:43])[cH:30][c:31]1[CH3:32].[O-:50][C:51]([O-:52])=[O:53].[O:54]=[CH:55][N:56]([CH3:57])[CH3:58].[OH:1][C:2]1=[CH:3][C:4](=[O:23])[O:5][C:6]([CH:8]2[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]2)([CH2:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([OH:22])[cH:20][cH:21]2)[CH2:7]1>>[OH:1][C:2]1=[C:3]([S:33][c:29]2[c:28]([C:44]([CH3:45])([CH3:46])[CH3:47])[cH:27][c:26]([NH2:25])[c:31]([CH3:32])[cH:30]2)[C:4](=[O:23])[O:5][C:6]([CH:8]2[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]2)([CH2:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([OH:22])[cH:20][cH:21]2)[CH2:7]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 10569823Toluene-4-thiosulfonic acid S-(4-amino-2-tert-butyl-5-methyl-phenyl) esterHCID 547203146-Cyclohexyl-4-hydroxy-6-[2-(4-hydroxy-phenyl)-ethyl]-5,6-dihydro-pyran-2-one

Product 1

HCID 54713197HCID 54713197, compound

Sources & evidence

ORD record
ord-d34acebc01794b3b8e1cd619c29c5a7e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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