2,3-Dihydroxybutanedioic Acid → 2,3-Dihydroxybutanedioic Acid

HRID 1218147Notes

Reaction equation

HRID 1218147 reaction equation
[C:30]([CH:31]([OH:32])[CH:33]([OH:34])[C:35](=[O:36])[OH:37])(=[O:38])[OH:39].[CH:14]12[CH2:15][N:16]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:17][CH:18]([CH2:19][NH:20][CH2:21]1)[CH2:22]2.[Cl:40][CH2:41][Cl:42].[O:1]1[CH:2]([CH2:4][O:5][c:6]2[cH:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]2)[CH2:3]1>>[C:30]([CH:31]([OH:32])[CH:33]([OH:34])[C:35](=[O:36])[OH:37])(=[O:38])[OH:39].[OH:1][CH:2]([CH2:3][N:20]1[CH2:19][CH:18]2[CH2:17][N:16]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:15][CH:14]([CH2:21]1)[CH2:22]2)[CH2:4][O:5][c:6]1[cH:7][cH:8][c:9]([C:10]#[N:11])[cH:12][cH:13]1

Participants

6

Reactant 4

HCID 8752,3-Dihydroxybutanedioic AcidHCID 6344DichloromethaneHCID 27643014-(2-Oxiranylmethoxy)benzenecarbonitrileHCID 22490264Tert-butyl 3,7-diazabicyclo(3.3.1)nonane-3-carboxylate

Product 2

HCID 8752,3-Dihydroxybutanedioic AcidHCID 53796099Tert-butyl 7-[3-(4-cyanophenoxy)-2-hydroxypropyl]-3,7-diazabicyclo[3.3.1]nonane-3-carboxylate

Sources & evidence

ORD record
ord-a036779a1c0349ac839d1c2af6c914c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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