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Water → 3-[3-(1-Benzyloxycarbonylamino-3-methyl-butyl)-isoxazol-5-yl]-acrylic acid ethyl ester

HRID 141192
Notes
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Reaction equation

HRID 141192 reaction equation
[C:30]([CH2:31][C:32]([OH:33])=[O:34])(=[O:35])[O:36][CH2:37][CH3:38].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH2:12][CH:13]([CH3:14])[CH3:15])[c:16]1[n:17][o:18][c:19]([CH:21]=[O:22])[cH:20]1)=[O:23].[OH2:39].[cH:24]1[cH:25][cH:26][n:27][cH:28][cH:29]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH2:12][CH:13]([CH3:14])[CH3:15])[c:16]1[n:17][o:18][c:19]([CH:21]=[CH:31][C:30](=[O:35])[O:36][CH2:37][CH3:38])[cH:20]1)=[O:23]
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 962WaterHCID 1049PyridineHCID 70615Monoethyl malonateHCID 18682349[1-(5-Formyl-isoxazol-3-yl)-3-methyl-butyl]-carbamic acid benzyl ester

Product 1

HCID 696932863-[3-(1-Benzyloxycarbonylamino-3-methyl-butyl)-isoxazol-5-yl]-acrylic acid ethyl ester

Sources & evidence

ORD record
ord-6bd4c5eebb2640a186098154602f6ae1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes