Bicarbonate Ion → HCID 178435296, compound

HRID 2342787Notes

Reaction equation

[CH2:28]([CH3:29])[O:30][C:31](=[O:32])[C:33]1([NH:38][C:39](=[O:40])[CH:41]2[NH:42][CH2:43][CH:44]([OH:46])[CH2:45]2)[CH:34]([CH:36]=[CH2:37])[CH2:35]1.[CH3:47][C:48]#[N:49].[NH2:1][CH:2]([C:3](=[O:4])[NH:5][CH:6]1[CH:7]([O:15][C:16]([CH3:17])=[O:18])[CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21)[C:19]([CH3:20])([CH3:21])[CH3:22].[Na+:27].[O-:23][C:24]([OH:25])=[O:26]>>[NH:1]([CH:2]([C:3](=[O:4])[NH:5][CH:6]1[CH:7]([O:15][C:16]([CH3:17])=[O:18])[CH2:8][c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]21)[C:19]([CH3:20])([CH3:21])[CH3:22])[C:24](=[O:23])[N:42]1[CH:41]([C:39]([NH:38][C:33]2([C:31]([O:30][CH2:28][CH3:29])=[O:32])[CH:34]([CH:36]=[CH2:37])[CH2:35]2)=[O:40])[CH2:45][CH:44]([OH:46])[CH2:43]1

Participants

Reactant 5

HCID 769Bicarbonate Ion

HCID 923Sodium ion

HCID 6342Acetonitrile

HCID 668712681-[(4-Hydroxy-pyrrolidine-2-carbonyl)-amino]-2-vinyl-cyclopropanecarboxylic acid ethyl ester

HCID 178475220HCID 178475220, compound

Product 1

HCID 178435296HCID 178435296, compound

Sources & evidence

ORD record: ord-a158595e42dc451cbabc582d420e7c7d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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