Bicarbonate Ion → HCID 58444571, compound

HRID 1560183Notes

Reaction equation

HRID 1560183 reaction equation
[Br:25][c:26]1[cH:27][c:28]([F:49])[c:29]([C:33]([O:34][c:35]2[cH:36][c:37]([F:46])[c:38]([C:42]([F:43])([F:44])[F:45])[c:39]([F:41])[cH:40]2)([F:47])[F:48])[c:30]([F:32])[cH:31]1.[C:57](=[O:58])([O-:59])[OH:60].[C:68]([O:69][CH3:70])([CH3:71])([CH3:72])[CH3:73].[CH2:1]([CH3:2])[CH:3]1[CH2:4][CH2:5][CH:6]([c:9]2[cH:10][c:11]([F:24])[c:12]([B:15]3[O:16][C:17]([CH3:18])([CH3:19])[C:20]([CH3:21])([CH3:22])[O:23]3)[cH:13][cH:14]2)[O:7][CH2:8]1.[CH2:62]1[O:63][CH2:64][CH2:65][CH2:66]1.[CH3:50][CH2:51][N:52]([CH2:53][CH3:54])[CH2:55][CH3:56].[K+:61].[OH2:67]>>[CH2:1]([CH3:2])[CH:3]1[CH2:4][CH2:5][CH:6]([c:9]2[cH:10][c:11]([F:24])[c:12](-[c:26]3[cH:27][c:28]([F:49])[c:29]([C:33]([O:34][c:35]4[cH:36][c:37]([F:46])[c:38]([C:42]([F:43])([F:44])[F:45])[c:39]([F:41])[cH:40]4)([F:47])[F:48])[c:30]([F:32])[cH:31]3)[cH:13][cH:14]2)[O:7][CH2:8]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 813Potassium CationHCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 15413tert-Butyl methyl etherHCID 58444567HCID 58444567, compoundHCID 58444590HCID 58444590, compound

Product 1

HCID 58444571HCID 58444571, compound

Sources & evidence

ORD record
ord-20aecc4468874e3a9814008f61f9218c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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