Hydrochloric Acid → Hydrochloric Acid

HRID 1211968Notes

Reaction equation

HRID 1211968 reaction equation
[C:52]([O:53][CH2:54][CH3:55])(=[O:56])[CH3:57].[CH2:59]1[O:60][CH2:61][CH2:62][O:63][CH2:64]1.[CH3:65][CH2:66][O:67][C:68](=[O:69])[CH3:70].[CH:1]1([c:4]2[cH:5][c:6]([C:16]([C:17](=[O:18])[NH:19][c:20]3[n:21][cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28]3)=[CH:29][CH:30]3[CH2:31][C:32]4([O:33][CH:42]([c:43]5[cH:44][cH:45][cH:46][cH:47][cH:48]5)[CH:35]([c:36]5[cH:37][cH:38][cH:39][cH:40][cH:41]5)[O:34]4)[CH2:49][CH2:50]3)[cH:7][cH:8][c:9]2[S:10](=[O:11])(=[O:12])[CH:13]2[CH2:14][CH2:15]2)[CH2:2][CH2:3]1.[ClH:51].[ClH:58]>>[CH:1]1([c:4]2[cH:5][c:6]([C:16]([C:17](=[O:18])[NH:19][c:20]3[n:21][cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28]3)=[CH:29][CH:30]3[CH2:31][C:32](=[O:33])[CH2:49][CH2:50]3)[cH:7][cH:8][c:9]2[S:10](=[O:11])(=[O:12])[CH:13]2[CH2:14][CH2:15]2)[CH2:2][CH2:3]1.[ClH:51]

Participants

6

Reactant 4

HCID 313Hydrochloric Acid2×HCID 8857Ethyl Acetate2×HCID 312751,4-DioxaneHCID 178522136HCID 178522136, compound

Product 2

HCID 313Hydrochloric AcidHCID 178516016HCID 178516016, compound

Sources & evidence

ORD record
ord-e32a988426ec43e0a6a262accc12d1f5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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