Methanol → HCID 178436131, compound

HRID 1231533Notes

Reaction equation

HRID 1231533 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[C:10]([OH:40])([c:41]2[c:42]([CH:57]=[CH2:58])[cH:43][c:44]([Cl:56])[c:45]([CH2:47][c:48]3[cH:49][cH:50][c:51]([CH2:54][CH3:55])[cH:52][cH:53]3)[cH:46]2)[O:11][CH:12]([CH2:31][O:32][CH2:33][c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH:13]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH:14]1[O:15][CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1.[CH2:69]1[O:70][CH2:71][CH2:72][CH2:73]1.[CH3:74][OH:75].[F:59][C:60]([F:61])([F:63])[C:64](=[O:62])[OH:65].[Li+:67].[OH-:66].[OH2:68].[OH2:76]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][CH:9]1[C:10]2([O:11][CH:12]([CH2:31][O:32][CH2:33][c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[CH:13]([O:23][CH2:24][c:25]3[cH:26][cH:27][cH:28][cH:29][cH:30]3)[CH:14]1[O:15][CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[c:41]1[c:42]([cH:43][c:44]([Cl:56])[c:45]([CH2:47][c:48]3[cH:49][cH:50][c:51]([CH2:54][CH3:55])[cH:52][cH:53]3)[cH:46]1)[CH:57]([OH:62])[CH2:58]2

Participants

8

Sources & evidence

ORD record
ord-400300a236874a05a295efbac479e0be
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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