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Pipecolic Acid → 1-[4-(5-Cyano-1-methylsulfonylindol-3-yl)piperidin-1-yl]sulfonylpiperidine-2-carboxylic acid

HRID 111165
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반응식

HRID 111165 반응식
[C:1](#[N:2])[c:3]1[cH:4][c:5]2[c:6]([CH:16]3[CH2:17][CH2:18][N:19]([S:22](=[O:23])(=[O:24])[Cl:25])[CH2:20][CH2:21]3)[cH:7][n:8]([S:12](=[O:13])(=[O:14])[CH3:15])[c:9]2[cH:10][cH:11]1.[C:31]([CH:32]([CH:33]([C:34]([OH:35])=[O:36])[OH:37])[OH:38])([OH:39])=[O:40].[NH:41]1[CH:42]([C:43](=[O:44])[OH:45])[CH2:46][CH2:47][CH2:48][CH2:49]1.[S:26]([Cl:27])([Cl:28])(=[O:29])=[O:30]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]2[c:6]([CH:16]3[CH2:17][CH2:18][N:19]([S:22](=[O:23])(=[O:24])[N:41]4[CH:42]([C:43](=[O:44])[OH:45])[CH2:46][CH2:47][CH2:48][CH2:49]4)[CH2:20][CH2:21]3)[cH:7][n:8]([S:12](=[O:13])(=[O:14])[CH3:15])[c:9]2[cH:10][cH:11]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 849Pipecolic AcidHCID 8752,3-Dihydroxybutanedioic AcidHCID 24648Sulfuryl chlorideHCID 226158104-(5-Cyano-1-methanesulfonylindol-3-yl)piperidine-1-sulfonyl chloride

생성물 1

HCID 226156041-[4-(5-Cyano-1-methylsulfonylindol-3-yl)piperidin-1-yl]sulfonylpiperidine-2-carboxylic acid

출처 및 근거

ORD 기록
ord-7c524b5abe934ceabf5ab71c1b7744f4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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