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Bicarbonate Ion → Ethyl 2-[2-[2-acetyloxy-5-(5-cyclohexyl-4-methyl-4-trimethylsilyloxypent-1-enyl)cyclopentyl]ethylsulfanyl]-1,3-thiazole-4-carboxylate

HRID 1133093
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인쇄 미리보기

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HRID 1133093 반응식
[C:41]([CH3:42])(=[O:43])[O:44][CH:45]1[CH:46]([CH2:52][CH2:53][S:54][c:55]2[s:56][cH:57][c:58]([C:60](=[O:61])[O:62][CH2:63][CH3:64])[n:59]2)[CH:47]([CH:50]=[O:51])[CH2:48][CH2:49]1.[C:65](=[O:66])([OH:67])[O-:68].[CH2:70]([CH2:71][O:72][CH3:73])[O:74][CH3:75].[CH3:31][Si:32]([N-:33][Si:34]([CH3:35])([CH3:36])[CH3:37])([CH3:38])[CH3:39].[CH:1]1([CH2:7][C:8]([CH2:9][CH2:10][S:11]([c:12]2[n:13](-[c:14]3[cH:15][cH:16][cH:17][cH:18][cH:19]3)[n:20][n:21][n:22]2)(=[O:23])=[O:24])([O:25][Si:26]([CH3:27])([CH3:28])[CH3:29])[CH3:30])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[K+:40].[Na+:69]>>[CH:1]1([CH2:7][C:8]([CH2:9][CH:10]=[CH:50][CH:47]2[CH:46]([CH2:52][CH2:53][S:54][c:55]3[s:56][cH:57][c:58]([C:60](=[O:61])[O:62][CH2:63][CH3:64])[n:59]3)[CH:45]([O:44][C:41]([CH3:42])=[O:43])[CH2:49][CH2:48]2)([O:25][Si:26]([CH3:27])([CH3:28])[CH3:29])[CH3:30])[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium IonHCID 80711,2-DimethoxyethaneHCID 3280088Npc316347HCID 231481365-({4-cyclohexyl-3-methyl-3-[(trimethylsilyl)oxy]butyl}sulfonyl)-1-phenyl-1H-tetrazole
HCID 87279900
Ethyl 2-[2-(2-acetyloxy-5-formylcyclopentyl)ethylsulfanyl]-1,3-thiazole-4-carboxylate

생성물 1

HCID 77223276Ethyl 2-[2-[2-acetyloxy-5-(5-cyclohexyl-4-methyl-4-trimethylsilyloxypent-1-enyl)cyclopentyl]ethylsulfanyl]-1,3-thiazole-4-carboxylate

출처 및 근거

ORD 기록
ord-327034e7950e45ec98a3d4a5f35a0f61
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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