Dichloromethane → 2-(3-(t-Butoxycarbonylamino)methylphenyl)-3-((1-(benzyloxycarbonyl)amino-2-methylpropyl)(ethoxy)phosphinoyl)propanoic acid methyl ester

HRID 1118636Notes

Reaction equation

HRID 1118636 reaction equation
[CH2:1]([CH3:2])[O:3][P:4]([OH:5])[CH:6]([CH:7]([CH3:8])[CH3:9])[NH:10][C:11](=[O:12])[O:13][CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[CH3:30][O:31][C:32]([C:33](=[CH2:34])[c:35]1[cH:36][c:37]([CH2:41][NH:42][C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[cH:38][cH:39][cH:40]1)=[O:50].[CH:21]([N:22]([CH2:23][CH3:24])[CH:25]([CH3:26])[CH3:27])([CH3:28])[CH3:29].[Cl:51][CH2:52][Cl:53]>>[CH2:1]([CH3:2])[O:3][P:4](=[O:5])([CH:6]([CH:7]([CH3:8])[CH3:9])[NH:10][C:11](=[O:12])[O:13][CH2:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1)[CH2:34][CH:33]([C:32]([O:31][CH3:30])=[O:50])[c:35]1[cH:36][c:37]([CH2:41][NH:42][C:43](=[O:44])[O:45][C:46]([CH3:47])([CH3:48])[CH3:49])[cH:38][cH:39][cH:40]1

Participants

5

Reactant 4

HCID 6344DichloromethaneHCID 81531DiisopropylethylamineHCID 673741311-(Benzyloxycarbonylamino)-2-methylpropylphosphonous acid ethyl esterHCID 673751012-(3-(t-Butoxycarbonylamino)methylphenyl)-propenoic acid methyl ester

Product 1

HCID 673761572-(3-(t-Butoxycarbonylamino)methylphenyl)-3-((1-(benzyloxycarbonyl)amino-2-methylpropyl)(ethoxy)phosphinoyl)propanoic acid methyl ester

Sources & evidence

ORD record
ord-4a25a5235ebd442ab73dd1b5c4ffca31
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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