Acetate → HCID 67519367, compound

HRID 295085Notes

Reaction equation

HRID 295085 reaction equation
[BH3:40].[C:41]([O-:42])(=[O:43])[CH3:44].[C:45]([O-:46])(=[O:47])[CH3:48].[C:49]([O-:50])(=[O:51])[CH3:52].[CH3:36][C:37](=[O:38])[OH:39].[F:19][C:20]([c:21]1[cH:22][cH:23][c:24]([N:27]2[CH:28]([CH3:33])[CH2:29][NH:30][CH2:31][CH2:32]2)[n:25][cH:26]1)([F:34])[F:35].[Na+:53].[Na+:54].[Na+:55].[O:1]=[C:2]1[O:3][c:4]2[c:5]([cH:8][c:9](-[c:12]3[c:13]([CH:17]=[O:18])[n:14][nH:15][n:16]3)[cH:10][cH:11]2)[CH2:6][NH:7]1.[O:56]=[CH:57][N:58]([CH3:59])[CH3:60]>>[O:1]=[C:2]1[O:3][c:4]2[c:5]([cH:8][c:9](-[c:12]3[c:13]([CH2:17][N:30]4[CH2:29][CH:28]([CH3:33])[N:27]([c:24]5[cH:23][cH:22][c:21]([C:20]([F:19])([F:34])[F:35])[cH:26][n:25]5)[CH2:32][CH2:31]4)[n:14][nH:15][n:16]3)[cH:10][cH:11]2)[CH2:6][NH:7]1

Participants

8

Reactant 7

HCID 175Acetate3×HCID 176Acetic AcidHCID 923Sodium ion3×HCID 6228DimethylformamideHCID 6331BoraneHCID 55104490HCID 55104490, compoundHCID 59410475HCID 59410475, compound

Product 1

HCID 67519367HCID 67519367, compound

Sources & evidence

ORD record
ord-de07f5a059d84098a2e82894ce11c199
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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