Acetic Acid → HCID 22727300, compound

HRID 687739Notes

Reaction equation

HRID 687739 reaction equation
[C:36]([BH3-:37])#[N:38].[CH3:32][C:33](=[O:34])[OH:35].[CH3:40][OH:41].[Na+:39].[n:1]1[cH:2][cH:3][c:4]([N:7]2[CH2:8][CH2:9][C:10](=[N:13][N:14]3[C:15](=[O:31])[CH2:16][N:17]([S:20](=[O:21])(=[O:22])[c:23]4[cH:24][cH:25][c:26]([CH:29]=[CH2:30])[cH:27][cH:28]4)[CH2:18][CH2:19]3)[CH2:11][CH2:12]2)[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([N:7]2[CH2:8][CH2:9][CH:10]([NH:13][N:14]3[C:15](=[O:31])[CH2:16][N:17]([S:20](=[O:21])(=[O:22])[c:23]4[cH:24][cH:25][c:26]([CH:29]=[CH2:30])[cH:27][cH:28]4)[CH2:18][CH2:19]3)[CH2:11][CH2:12]2)[cH:5][cH:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 69545943HCID 69545943, compound

Product 1

HCID 22727300HCID 22727300, compound

Sources & evidence

ORD record
ord-a87f43ef378e4c49bd6f7be30471649a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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