Acetic Acid → HCID 11151078, compound

HRID 1133613Notes

Reaction equation

HRID 1133613 reaction equation
[BH4-:24].[C:26]([NH:27][c:28]1[cH:29][cH:30][c:31]2[c:39]([cH:40]1)[CH2:38][c:33]1[c:32]-2[cH:37][cH:36][cH:35][cH:34]1)([O:41][C:42]([CH3:43])([CH3:44])[CH3:45])=[O:46].[C:47]([O:48][CH3:49])([CH3:50])([CH3:51])[CH3:52].[C:62]([OH:63])(=[O:64])[CH3:65].[CH3:53][OH:54].[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[CH:1](=[O:2])[CH:3]1[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2-[c:10]2[cH:11][cH:12][c:13]([NH:16][C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[cH:14][c:15]21.[Na+:25].[OH2:55]>>[CH2:1]([OH:2])[CH:3]1[c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]2-[c:10]2[cH:11][cH:12][c:13]([NH:16][C:17](=[O:18])[O:19][C:20]([CH3:21])([CH3:22])[CH3:23])[cH:14][c:15]21

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 8857Ethyl AcetateHCID 15413tert-Butyl methyl etherHCID 28123BorohydrideHCID 113120632-(Boc-amino)fluoreneHCID 11347396HCID 11347396, compound

Product 1

HCID 11151078HCID 11151078, compound

Sources & evidence

ORD record
ord-705607bff0c8435dafa3f1ee45829c2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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