2-Aminomethyl-4,4,8-trimethyl-nonanoic acid → 3-Amino-2-[1-(4-methyl-pentyl)-cyclopropylmethyl]-propionic Acid

HRID 315226Notes

Reaction equation

HRID 315226 reaction equation
[CH:31]1([C:32]([O:33][c:34]2[c:35]([C:36]([CH3:37])([CH3:38])[CH3:39])[cH:40][c:41]([CH3:42])[cH:43][c:44]2[C:45]([CH3:46])([CH3:47])[CH3:48])=[O:49])[CH2:50][CH2:51]1.[NH2:17][CH2:18][CH:19]([CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH:25]([CH3:26])[CH3:27])[C:28]([OH:29])=[O:30].[NH2:1][CH2:2][CH:3]([C:4](=[O:5])[OH:6])[CH2:7][C:8]([CH2:9][CH2:10][CH2:11][CH:12]([CH3:13])[CH3:14])([CH3:15])[CH3:16]>>[NH2:1][CH2:2][CH:3]([C:4](=[O:5])[OH:6])[CH2:7][C:8]1([CH2:9][CH2:10][CH2:11][CH:12]([CH3:13])[CH3:14])[CH2:15][CH2:16]1

Participants

4

Reactant 3

HCID 103079982-Aminomethyl-4,4,8-trimethyl-nonanoic acidHCID 13676039Cyclopropanecarboxylic acid 2,6-di-tert-butyl-4-methyl-phenyl esterHCID 219434912-(Aminomethyl)-8-methylnonanoic acid

Product 1

HCID 101491443-Amino-2-[1-(4-methyl-pentyl)-cyclopropylmethyl]-propionic Acid

Sources & evidence

ORD record
ord-df50ff7e1ffc4ec4ba6a35ee811e4416
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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