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Bicarbonate Ion → tert-butyl N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate

HRID 305845
Notes
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Reaction equation

HRID 305845 reaction equation
[C:29]([O-:30])(=[O:31])[CH2:32][CH2:33][C:34]([O-:35])=[O:36].[CH3:42][c:43]1[c:44]([O:45][CH2:46][C:47](=[O:48])[Cl:49])[c:50]([CH3:54])[cH:51][cH:52][cH:53]1.[CH3:55][CH2:56][O:57][C:58]([CH3:59])=[O:60].[NH2:1][CH:2]([CH2:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[CH:10]([CH2:11][CH:12]([CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[OH:28].[Na+:41].[O-:37][C:38]([OH:39])=[O:40].[OH2:61]>>[NH:1]([CH:2]([CH2:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)[CH:10]([CH2:11][CH:12]([CH2:13][c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[NH:20][C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[OH:28])[C:47]([CH2:46][O:45][c:44]1[c:43]([CH3:42])[cH:53][cH:52][cH:51][c:50]1[CH3:54])=[O:48]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 8857Ethyl AcetateHCID 160419SuccinateHCID 12353505(2,6-Dimethylphenoxy)acetyl ChlorideHCID 18758861tert-butyl N-(4-amino-1-benzyl-3-hydroxy-5-phenyl-pentyl)carbamate

Product 1

HCID 53446070tert-butyl N-[5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]carbamate

Sources & evidence

ORD record
ord-511648a117d941deafd1f03711e48894
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes