Bicarbonate Ion → HCID 66671463, compound

HRID 2320880Notes

Reaction equation

[C:57]([O:58][CH2:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1)(=[O:66])[Cl:67].[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[Cl:73][CH2:74][Cl:75].[Na+:68].[OH:69][C:70](=[O:71])[O-:72].[c:1]1(-[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:2]([NH:7][C:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][N:18]([CH3:19])[C:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][NH:26][c:27]3[cH:28][cH:29][c:30]([N:33]([CH3:34])[C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[cH:31][cH:32]3)=[O:42])[CH2:14][CH2:15]2)=[O:43])[cH:3][cH:4][cH:5][cH:6]1>>[c:1]1(-[c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:2]([NH:7][C:8]([O:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][N:18]([CH3:19])[C:20]([CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][N:26]([c:27]3[cH:28][cH:29][c:30]([N:33]([CH3:34])[C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[cH:31][cH:32]3)[C:57]([O:58][CH2:59][c:60]3[cH:61][cH:62][cH:63][cH:64][cH:65]3)=[O:66])=[O:42])[CH2:14][CH2:15]2)=[O:43])[cH:3][cH:4][cH:5][cH:6]1

Participants

Reactant 6

HCID 769Bicarbonate Ion

HCID 923Sodium ion

HCID 6344Dichloromethane

HCID 8471Triethylamine

HCID 10387Benzyl chloroformate

HCID 66671689HCID 66671689, compound

Product 1

HCID 66671463HCID 66671463, compound

Sources & evidence

ORD record: ord-ddeda25b90a44e5b916b668b47574f79
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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