Methanol → HCID 178444766, compound

HRID 210644Notes

Reaction equation

HRID 210644 reaction equation
[CH2:56]1[O:57][CH2:58][CH2:59][CH2:60]1.[CH3:1][CH:2]([CH:3]([C:4]([NH:5][CH2:6][CH:7]1[CH2:8][CH2:9][O:10][CH2:11][CH2:12]1)=[S:13])[NH:14][C:15](=[O:16])[C:17]1([NH:34][C:35]([CH:36]([CH:37]([CH2:38][CH3:39])[CH3:40])[NH:41][C:42]([CH2:43][c:44]2[c:45]([F:50])[cH:46][cH:47][cH:48][cH:49]2)=[O:51])=[O:52])[CH2:18][CH2:19][c:20]2[nH:21][c:22]3[c:23]([C:30]([F:31])([F:32])[F:33])[cH:24][cH:25][cH:26][c:27]3[c:28]2[CH2:29]1)[CH2:53][CH3:54].[CH3:61][OH:62].[Na:55].[Ni:69]([Cl:70])[Cl:71].[OH2:63].[OH2:64].[OH2:65].[OH2:66].[OH2:67].[OH2:68]>>[CH3:1][CH:2]([CH:3]([CH2:4][NH:5][CH2:6][CH:7]1[CH2:8][CH2:9][O:10][CH2:11][CH2:12]1)[NH:14][C:15](=[O:16])[C:17]1([NH:34][C:35]([CH:36]([CH:37]([CH2:38][CH3:39])[CH3:40])[NH:41][C:42]([CH2:43][c:44]2[c:45]([F:50])[cH:46][cH:47][cH:48][cH:49]2)=[O:51])=[O:52])[CH2:18][CH2:19][c:20]2[nH:21][c:22]3[c:23]([C:30]([F:31])([F:32])[F:33])[cH:24][cH:25][cH:26][c:27]3[c:28]2[CH2:29]1)[CH2:53][CH3:54]

Participants

7

Reactant 6

HCID 887MethanolHCID 962Water6×HCID 8028TetrahydrofuranHCID 24385Nickel DichlorideHCID 5360545SodiumHCID 178446522HCID 178446522, compound

Product 1

HCID 178444766HCID 178444766, compound

Sources & evidence

ORD record
ord-2433ea8a0f9b4a89930156eb185d2b9a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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