Bicarbonate Ion → HCID 178449430, compound

HRID 687102Notes

Reaction equation

HRID 687102 reaction equation
[C:64](=[O:65])([O-:66])[OH:67].[CH2:1]([O:2][P:3]([O:4][CH2:5][CH3:6])(=[O:7])[CH2:9][c:10]1[c:11]([C:22](=[O:23])[N:24]([CH:25]2[CH2:26][N:27]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:28][CH:29]([C:31](=[O:32])[N:33]3[CH2:34][CH2:35][O:36][CH2:37][CH2:38]3)[CH2:30]2)[CH2:46][CH:47]([CH3:48])[CH3:49])[n:12][n:13][n:14]1-[c:15]1[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]1)[CH3:8].[CH2:59]1[O:60][CH2:61][CH2:62][CH2:63]1.[H-:57].[Na+:58].[Na+:68].[s:50]1[c:51]([CH:55]=[O:56])[n:52][cH:53][cH:54]1>>[CH:9]([c:10]1[c:11]([C:22](=[O:23])[N:24]([CH:25]2[CH2:26][N:27]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:28][CH:29]([C:31](=[O:32])[N:33]3[CH2:34][CH2:35][O:36][CH2:37][CH2:38]3)[CH2:30]2)[CH2:46][CH:47]([CH3:48])[CH3:49])[n:12][n:13][n:14]1-[c:15]1[c:16]([F:21])[cH:17][cH:18][cH:19][cH:20]1)=[CH:55][c:51]1[s:50][cH:54][cH:53][n:52]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 8028TetrahydrofuranHCID 166653HydrideHCID 27349031,3-Thiazole-2-carbaldehydeHCID 178476880HCID 178476880, compound

Product 1

HCID 178449430HCID 178449430, compound

Sources & evidence

ORD record
ord-22e0698bf79e456da951ccdde39c631e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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