Acetate → HCID 23122565, compound

HRID 281414Notes

Reaction equation

HRID 281414 reaction equation
[C:35]([O:36][BH-:37]([O:38][C:39](=[O:40])[CH3:41])[O:42][C:43](=[O:44])[CH3:45])(=[O:46])[CH3:47].[CH3:31][C:32](=[O:33])[O-:34].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[CH:23](=[O:24])[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[NH2:1][c:2]1[c:3]([NH:12][S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[Na+:48].[OH2:54]>>[NH:1]([c:2]1[c:3]([NH:12][S:13](=[O:14])(=[O:15])[c:16]2[cH:17][cH:18][c:19]([CH3:22])[cH:20][cH:21]2)[n:4][cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1)[CH2:23][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1

Participants

8

Reactant 7

HCID 175AcetateHCID 240BenzaldehydeHCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 2724942TriacetoxyborohydrideHCID 23122654HCID 23122654, compound

Product 1

HCID 23122565HCID 23122565, compound

Sources & evidence

ORD record
ord-922e4571e550421b8b417a50aef19f5d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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