Acetic Acid → HCID 21054829, compound

HRID 2127211Notes

Reaction equation

HRID 2127211 reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH2:32]=[O:33].[CH3:34][C:35](=[O:36])[OH:37].[CH3:57][OH:58].[NH:1]1[CH2:2][CH2:3][CH:4]([NH:7][C:8](=[O:9])[n:10]2[cH:11][cH:12][c:13]3[cH:14][c:15]([O:19][c:20]4[cH:21][c:22]([NH:26][C:27](=[O:28])[NH:29][CH2:30][CH3:31])[n:23][cH:24][cH:25]4)[cH:16][cH:17][c:18]23)[CH2:5][CH2:6]1.[Na+:51].[O:52]1[CH2:53][CH2:54][CH2:55][CH2:56]1>>[N:1]1([CH3:34])[CH2:2][CH2:3][CH:4]([NH:7][C:8](=[O:9])[n:10]2[cH:11][cH:12][c:13]3[cH:14][c:15]([O:19][c:20]4[cH:21][c:22]([NH:26][C:27](=[O:28])[NH:29][CH2:30][CH3:31])[n:23][cH:24][cH:25]4)[cH:16][cH:17][c:18]23)[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 712FormaldehydeHCID 887MethanolHCID 923Sodium ionHCID 8028TetrahydrofuranHCID 2724942TriacetoxyborohydrideHCID 21054831HCID 21054831, compound

Product 1

HCID 21054829HCID 21054829, compound

Sources & evidence

ORD record
ord-145376030d1c435aa41a31ce1208fc11
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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