Hydroxide → 2-[[4-[4-[(5-Acetyl-4-hydroxy-3-methyl-1-benzofuran-2-carbonyl)amino]phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid

HRID 675991Notes

Reaction equation

HRID 675991 reaction equation
[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:1][O:2][C:3]([CH:4]([CH:5]([CH3:6])[CH3:7])[NH:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15](-[c:18]2[cH:19][cH:20][c:21]([NH:24][C:25](=[O:26])[c:27]3[o:28][c:29]4[c:30]([c:31]3[CH3:32])[c:33]([OH:40])[c:34]([C:37]([CH3:38])=[O:39])[cH:35][cH:36]4)[cH:22][cH:23]2)[cH:16][cH:17]1)=[O:41].[Li+:43].[OH-:42]>>[O:2]=[C:3]([CH:4]([CH:5]([CH3:6])[CH3:7])[NH:8][S:9](=[O:10])(=[O:11])[c:12]1[cH:13][cH:14][c:15](-[c:18]2[cH:19][cH:20][c:21]([NH:24][C:25](=[O:26])[c:27]3[o:28][c:29]4[c:30]([c:31]3[CH3:32])[c:33]([OH:40])[c:34]([C:37]([CH3:38])=[O:39])[cH:35][cH:36]4)[cH:22][cH:23]2)[cH:16][cH:17]1)[OH:41]

Participants

5

Reactant 4

HCID 961HydroxideHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 68716410HCID 68716410, compound

Product 1

HCID 687129302-[[4-[4-[(5-Acetyl-4-hydroxy-3-methyl-1-benzofuran-2-carbonyl)amino]phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid

Sources & evidence

ORD record
ord-7654ebccbdfe44289dd58996034ab149
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…