Methanol → HCID 15342540, compound

HRID 693601Notes

Reaction equation

HRID 693601 reaction equation
[CH3:3][CH:4]([CH3:5])[O:6][C:7](=[O:8])[c:9]1[c:10]([CH2:45][O:46][CH3:47])[c:11]2[c:12]([n:13]([CH2:30][C:31](=[O:32])[N:33]([CH2:34][CH2:35][c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH3:42])[c:14]3[cH:15][cH:16][cH:17][c:18]([O:20][c:21]4[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]4)[c:19]23)[cH:43][n:44]1.[CH3:53][OH:54].[CH3:60][CH2:61][O:62][C:63](=[O:64])[CH3:65].[Li+:1].[O:55]1[CH2:56][CH2:57][CH2:58][CH2:59]1.[OH-:2].[S:48](=[O:49])(=[O:50])([OH:51])[OH:52]>>[O:6]=[C:7]([OH:8])[c:9]1[c:10]([CH2:45][O:46][CH3:47])[c:11]2[c:12]([n:13]([CH2:30][C:31](=[O:32])[N:33]([CH2:34][CH2:35][c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[CH3:42])[c:14]3[cH:15][cH:16][cH:17][c:18]([O:20][c:21]4[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]4)[c:19]23)[cH:43][n:44]1

Participants

8

Reactant 7

HCID 887MethanolHCID 961HydroxideHCID 1118Sulfuric AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 15342539HCID 15342539, compound

Product 1

HCID 15342540HCID 15342540, compound

Sources & evidence

ORD record
ord-b6fd5aa1895b41e5bfc1ea7967d3b971
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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