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Chloride → HCID 59331382, 화합물

HRID 2122661
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인쇄 미리보기

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HRID 2122661 반응식
[CH2:53]([n+:54]1[c:55]([CH3:56])[c:57]([CH2:58][CH2:59][OH:60])[s:61][cH:62]1)[c:63]1[cH:64][cH:65][cH:66][cH:67][cH:68]1.[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[CH3:69][CH2:70][OH:71].[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14]([CH:15]=[CH2:16])=[O:17])[CH2:18][CH:19]3[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[cH:11][cH:12]2)[CH2:2][CH2:3]1.[Cl-:52].[O:25]1[CH:26]([O:31][CH2:32][c:33]2[cH:34][n:35][c:36]([CH:38]=[O:39])[s:37]2)[CH2:27][CH2:28][CH2:29][CH2:30]1.[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1>>[CH:1]1([S:4](=[O:5])(=[O:6])[c:7]2[cH:8][cH:9][c:10]([CH:13]([C:14]([CH2:15][CH2:16][C:38]([c:36]3[n:35][cH:34][c:33]([CH2:32][O:31][CH:26]4[O:25][CH2:30][CH2:29][CH2:28][CH2:27]4)[s:37]3)=[O:39])=[O:17])[CH2:18][CH:19]3[CH2:20][CH2:21][O:22][CH2:23][CH2:24]3)[cH:11][cH:12]2)[CH2:2][CH2:3]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 312ChlorideHCID 702EthanolHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 4253053-Benzyl-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-iumHCID 593312584-[4-(cyclopropylsulfonyl)phenyl]-5-(tetrahydro-2H-pyran-4-yl)pent-1-en-3-one
HCID 59331305
5-[(tetrahydro-2H-pyran-2-yloxy)methyl]-1,3-thiazole-2-carbaldehyde

생성물 1

HCID 59331382HCID 59331382, 화합물

출처 및 근거

ORD 기록
ord-69157baf1b964d4ab978721094d9ac25
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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