Bicarbonate Ion → HCID 178486957, compound

HRID 1232531Notes

Reaction equation

HRID 1232531 reaction equation
[C:45](=[O:46])([OH:47])[O-:48].[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[CH:1]1([CH2:4][N:5]2[CH:6]3[C:7]4([OH:27])[CH:8]=[CH:9][CH:10]([NH:25][CH3:26])[CH:11]5[C:12]4([c:13]4[c:14]([c:15]([O:20][CH3:21])[cH:16][cH:17][c:18]4[CH2:19]3)[O:22]5)[CH2:23][CH2:24]2)[CH2:2][CH2:3]1.[CH:50]([Cl:51])([Cl:52])[Cl:53].[Na+:49].[o:35]1[cH:36][c:37]([CH:40]=[CH:41][C:42](=[O:43])[Cl:44])[cH:38][cH:39]1>>[CH:1]1([CH2:4][N:5]2[CH:6]3[C:7]4([OH:27])[CH:8]=[CH:9][CH:10]([N:25]([CH3:26])[C:42]([CH:41]=[CH:40][c:37]5[cH:36][o:35][cH:39][cH:38]5)=[O:43])[CH:11]5[C:12]4([c:13]4[c:14]([c:15]([O:20][CH3:21])[cH:16][cH:17][c:18]4[CH2:19]3)[O:22]5)[CH2:23][CH2:24]2)[CH2:2][CH2:3]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6212ChloroformHCID 8471TriethylamineHCID 54034096HCID 54034096, compoundHCID 178482083HCID 178482083, compound

Product 1

HCID 178486957HCID 178486957, compound

Sources & evidence

ORD record
ord-044d4c4b89354c28ad9e15c52ffcbbf0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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