Bicarbonate Ion → HCID 23152494, compound

HRID 1228040Notes

Reaction equation

HRID 1228040 reaction equation
[C:51](=[O:52])([O-:53])[OH:54].[CH3:66][N:67]([CH3:68])[CH:69]=[O:70].[CH:1]1([c:7]2[c:8]3[c:9]([n:10]4[c:16]2-[c:15]2[c:14]([cH:20][c:19]([O:21][CH3:22])[cH:18][cH:17]2)[O:13][CH2:12][CH2:11]4)[cH:23][c:24]([C:27](=[O:28])[NH:29][C:30]([C:31](=[O:32])[OH:33])([CH3:34])[CH3:35])[cH:25][cH:26]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[CH:56]([Cl:57])([Cl:58])[Cl:59].[NH2:40][c:41]1[cH:42][cH:43][c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50]1.[Na+:55].[S:36]([Cl:37])([Cl:38])=[O:39].[cH:60]1[cH:61][cH:62][n:63][cH:64][cH:65]1>>[CH:1]1([c:7]2[c:8]3[c:9]([n:10]4[c:16]2-[c:15]2[c:14]([cH:20][c:19]([O:21][CH3:22])[cH:18][cH:17]2)[O:13][CH2:12][CH2:11]4)[cH:23][c:24]([C:27](=[O:28])[NH:29][C:30]([C:31](=[O:32])[NH:40][c:41]2[cH:42][cH:43][c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50]2)([CH3:34])[CH3:35])[cH:25][cH:26]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1049PyridineHCID 6212ChloroformHCID 6228DimethylformamideHCID 12082Methyl 4-aminobenzoateHCID 24386Thionyl ChlorideHCID 23152318HCID 23152318, compound

Product 1

HCID 23152494HCID 23152494, compound

Sources & evidence

ORD record
ord-8e5767b389aa47df8f62b82fd4b626b5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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