Methanol → HCID 19991747, compound

HRID 1153505Notes

Reaction equation

HRID 1153505 reaction equation
[CH2:36]([CH2:37][CH2:38][CH3:39])[NH2:40].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:52][OH:53].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][c:9]([N:19]3[C:20]([CH3:28])([CH3:29])[CH2:21][C:22](=[O:27])[CH2:23][C:24]3([CH3:25])[CH3:26])[n:10][c:11]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[n:12]2)[CH2:5][CH2:6]1.[c:41]1([CH3:42])[cH:43][cH:44][c:45]([S:46]([OH:47])(=[O:48])=[O:49])[cH:50][cH:51]1>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[n:8][c:9]([N:19]3[C:20]([CH3:28])([CH3:29])[CH2:21][CH:22]([NH:40][CH2:36][CH2:37][CH2:38][CH3:39])[CH2:23][C:24]3([CH3:25])[CH3:26])[n:10][c:11]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[n:12]2)[CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 887MethanolHCID 6101p-Toluenesulfonic acidHCID 8007ButylamineHCID 8857Ethyl AcetateHCID 19991750HCID 19991750, compound

Product 1

HCID 19991747HCID 19991747, compound

Sources & evidence

ORD record
ord-952880d4a14247b89683ae6b7f8c3cec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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