Bicarbonate Ion → HCID 178495476, compound

HRID 134208Notes

Reaction equation

HRID 134208 reaction equation
[CH3:48][S:49](=[O:50])(=[O:51])[OH:52].[CH3:53][CH2:54][N:55]([CH2:56][CH3:57])[CH2:58][CH3:59].[Na+:60].[O:65]1[CH2:66][CH2:67][CH2:68][CH2:69]1.[OH:1][CH:2]([CH:3]([CH2:4][O:5][Si:6]([CH:7]([CH3:8])[CH3:9])([CH:10]([CH3:11])[CH3:12])[CH:13]([CH3:14])[CH3:15])[NH:16][C:17](=[O:18])[c:19]1[nH:20][c:21](-[c:24]2[cH:25][c:26]([O:41][CH:42]([CH2:43][O:44][CH3:45])[CH3:46])[cH:27][c:28]([O:30][c:31]3[cH:32][n:33][c:34]([S:37](=[O:38])(=[O:39])[CH3:40])[cH:35][cH:36]3)[cH:29]2)[cH:22][cH:23]1)[CH3:47].[OH:61][C:62](=[O:63])[O-:64]>>[O:1]1[CH:2]([CH3:47])[CH:3]([CH2:4][O:5][Si:6]([CH:7]([CH3:8])[CH3:9])([CH:10]([CH3:11])[CH3:12])[CH:13]([CH3:14])[CH3:15])[N:16]=[C:17]1[c:19]1[nH:20][c:21](-[c:24]2[cH:25][c:26]([O:41][CH:42]([CH2:43][O:44][CH3:45])[CH3:46])[cH:27][c:28]([O:30][c:31]3[cH:32][n:33][c:34]([S:37](=[O:38])(=[O:39])[CH3:40])[cH:35][cH:36]3)[cH:29]2)[cH:22][cH:23]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6395Methanesulfonic AcidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 178495479HCID 178495479, compound

Product 1

HCID 178495476HCID 178495476, compound

Sources & evidence

ORD record
ord-d5ba412745d846978978eb0fdd25f9b7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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