Methanol → HCID 11787635, compound

HRID 2318565Notes

Reaction equation

HRID 2318565 reaction equation
[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH3:63][OH:64].[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:42][CH2:43][NH:44][S:45](=[O:46])(=[O:47])[CH2:48][c:49]2[c:50]([Cl:55])[cH:51][cH:52][cH:53][cH:54]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH2:35][CH2:36][C:37](=[O:38])[O:39][CH2:40][CH3:41])[cH:33][cH:34]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12.[Na+:62].[OH-:61]>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[n:14]1[c:15]([CH2:42][CH2:43][NH:44][S:45](=[O:46])(=[O:47])[CH2:48][c:49]2[c:50]([Cl:55])[cH:51][cH:52][cH:53][cH:54]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH2:35][CH2:36][C:37](=[O:38])[OH:39])[cH:33][cH:34]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 11205124HCID 11205124, compound

Product 1

HCID 11787635HCID 11787635, compound

Sources & evidence

ORD record
ord-5216f64f47be48fdb0b28998af2d38fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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