Acetonitrile → Methyl 5-(2-(benzyloxycarbonylamino)-4-methylpentanamido)-2-hydroxybenzoate

HRID 203071

Reaction equation

HRID 203071 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13](=[O:14])[OH:15])[CH2:16][CH:17]([CH3:18])[CH3:19].[CH3:32][CH2:33][N:34]([CH2:35][CH3:36])[CH2:37][CH3:38].[CH3:63][C:64]#[N:65].[NH2:20][c:21]1[cH:22][cH:23][c:24]([OH:31])[c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30]1.[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45].[n:46]1([O:47][C:48]([N:49]([CH3:50])[CH3:51])=[N+:52]([CH3:53])[CH3:54])[c:55]2[n:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13](=[O:15])[NH:20][c:21]1[cH:22][cH:23][c:24]([OH:31])[c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30]1)[CH2:16][CH:17]([CH3:18])[CH3:19]

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 135127Methyl 5-amino-2-hydroxybenzoateHCID 2466732-(((Benzyloxy)carbonyl)amino)-4-methylpentanoic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 59193171Methyl 5-(2-(benzyloxycarbonylamino)-4-methylpentanamido)-2-hydroxybenzoate

Sources & evidence

ORD record
ord-dc31717682be46118bb3e28c1894e719
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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