Hydrochloric Acid → HCID 68501321, compound

HRID 2312821Notes

Reaction equation

[CH3:1][O:2][c:3]1[c:4]([CH2:5][O:6][CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14]([CH:17]3[CH:18]([O:30][CH2:31][CH2:32][O:33][S:34]([c:35]4[cH:36][cH:37][c:38]([CH3:39])[cH:40][cH:41]4)(=[O:42])=[O:43])[CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[cH:15][cH:16]2)[cH:44][cH:45][cH:46][cH:47]1.[CH3:64][OH:65].[CH3:67][CH2:68][O:69][C:70](=[O:71])[CH3:72].[ClH:63].[Na+:62].[OH-:61].[OH2:66].[OH:48][c:49]1[c:50]([CH2:55][CH2:56][CH2:57][C:58](=[O:59])[OH:60])[cH:51][cH:52][cH:53][cH:54]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][O:6][CH2:7][CH2:8][CH2:9][O:10][c:11]2[cH:12][cH:13][c:14]([CH:17]3[CH:18]([O:30][CH2:31][CH2:32][O:33][c:49]4[c:50]([CH2:55][CH2:56][CH2:57][C:58](=[O:59])[OH:60])[cH:51][cH:52][cH:53][cH:54]4)[CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]3)[cH:15][cH:16]2)[cH:44][cH:45][cH:46][cH:47]1

Participants

Reactant 8

HCID 313Hydrochloric Acid

HCID 8857Ethyl Acetate

HCID 41894984-(2-Hydroxyphenyl)butanoic acid

HCID 86609984Tert-butyl 4-{4-[3-(2-methoxybenzyloxy)propoxy]phenyl}-3-[2-(toluene-4-sulphonyloxy)ethoxy]piperidine-1-carboxylate

Product 1

HCID 68501321HCID 68501321, compound

Sources & evidence

ORD record: ord-be29a0b85be74582b94350a9de48cc08
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…