Methanol → HCID 178525323, compound

HRID 171642Notes

Reaction equation

HRID 171642 reaction equation
[C:36]([O:37][CH2:38][CH3:39])(=[O:40])[CH3:41].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][C:6]([CH:7]([NH:8][C:9](=[O:10])[C:11]1([NH:16][C:17](=[O:18])[C:19]2([SH:24])[CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:12][CH2:13][CH2:14][CH2:15]1)[CH2:25][c:26]1[cH:27][cH:28][c:29]([OH:32])[cH:30][cH:31]1)=[O:33].[CH3:42][CH2:43][CH2:44][CH2:45][CH2:46][CH3:47].[CH3:48][OH:49].[Na+:35].[OH-:34]>>[O:5]=[C:6]([CH:7]([NH:8][C:9](=[O:10])[C:11]1([NH:16][C:17](=[O:18])[C:19]2([SH:24])[CH2:20][CH2:21][CH2:22][CH2:23]2)[CH2:12][CH2:13][CH2:14][CH2:15]1)[CH2:25][c:26]1[cH:27][cH:28][c:29]([OH:32])[cH:30][cH:31]1)[OH:33]

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 178450916HCID 178450916, compound

Product 1

HCID 178525323HCID 178525323, compound

Sources & evidence

ORD record
ord-f1af99a0407246cd93abbe491a5970bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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