Methanol → HCID 21962498, compound

HRID 2128695Notes

Reaction equation

HRID 2128695 reaction equation
[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[CH3:66][OH:67].[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]([CH2:44][CH2:45][NH:46][S:47](=[O:48])(=[O:49])[CH2:50][c:51]2[cH:52][c:53]([Cl:58])[c:54]([Cl:57])[cH:55][cH:56]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH2:35][C:36]([C:37](=[O:38])[O:39][CH2:40][CH3:41])([CH3:42])[CH3:43])[cH:33][cH:34]2)[c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][c:22]12.[Na+:65].[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]([CH2:44][CH2:45][NH:46][S:47](=[O:48])(=[O:49])[CH2:50][c:51]2[cH:52][c:53]([Cl:58])[c:54]([Cl:57])[cH:55][cH:56]2)[c:16]([CH2:24][CH2:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH2:35][C:36]([C:37](=[O:38])[OH:39])([CH3:42])[CH3:43])[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 21962452HCID 21962452, compound

Product 1

HCID 21962498HCID 21962498, compound

Sources & evidence

ORD record
ord-6de9c432b5fd4bf7b53a3a74e35cb5f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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