Acetic Acid → HCID 18727100, compound

HRID 2326831Notes

Reaction equation

HRID 2326831 reaction equation
[C:32]([BH3-:33])#[N:34].[CH3:28][C:29](=[O:30])[OH:31].[CH3:36][OH:37].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([N:10]2[CH2:11][CH2:12][C:13](=[O:16])[CH2:14][CH2:15]2)[cH:6][cH:7][cH:8][cH:9]1.[NH2:17][CH2:18][CH2:19][NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27].[Na+:35]>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([N:10]2[CH2:11][CH2:12][CH:13]([NH:17][CH2:18][CH2:19][NH:20][C:21]([O:22][C:23]([CH3:24])([CH3:25])[CH3:26])=[O:27])[CH2:14][CH2:15]2)[cH:6][cH:7][cH:8][cH:9]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 187201N-BOC-ethylenediamineHCID 498716Cyano-borohydrideHCID 2907754HCID 2907754, compound

Product 1

HCID 18727100HCID 18727100, compound

Sources & evidence

ORD record
ord-1bec273126ff45b3b0168d4ea2ddb6c2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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