Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI) → 2-tert-butoxycarbonyloxy-4-[3-(1-tert-butoxycarbonyl-3,4-dimethyl-1H-pyrrol-2-yl)-3-hydroxy-prop-1-ynyl]-5-fluoro-indole-1-carboxylic acid tert-butyl ester

HRID 1139398Notes

Reaction equation

HRID 1139398 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([O:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:10][c:11]2[c:12]([I:18])[c:13]([F:17])[cH:14][cH:15][c:16]12.[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32](=[O:33])[n:34]1[c:35]([CH:41]([C:42]#[CH:43])[OH:44])[c:36]([CH3:40])[c:37]([CH3:39])[cH:38]1.[Cu:45][I:46]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9]([O:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:10][c:11]2[c:12]([C:43]#[C:42][CH:41]([c:35]3[n:34]([C:32]([O:31][C:27]([CH3:28])([CH3:29])[CH3:30])=[O:33])[cH:38][c:37]([CH3:39])[c:36]3[CH3:40])[OH:44])[c:13]([F:17])[cH:14][cH:15][c:16]12

Participants

4

Reactant 3

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 102058642-Tert-butoxycarbonyloxy-5-fluoro-4-iodo-indole-1-carboxylic acid tert-butyl esterHCID 235502733,4-Dimethyl-2-(1-hydroxy-prop-2-ynyl)-pyrrole-1-carboxylic acid tert-butyl ester

Product 1

HCID 101214212-tert-butoxycarbonyloxy-4-[3-(1-tert-butoxycarbonyl-3,4-dimethyl-1H-pyrrol-2-yl)-3-hydroxy-prop-1-ynyl]-5-fluoro-indole-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-f42fd65e7c854a09adf9225b0b7c328b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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