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Acetic Acid → tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methyl-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

HRID 833789
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인쇄 미리보기

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HRID 833789 반응식
[C:41]([O:42][BH-:43]([O:44][C:45](=[O:46])[CH3:47])[O:48][C:49](=[O:50])[CH3:51])(=[O:52])[CH3:53].[C:55](=[O:56])([O-:57])[OH:58].[CH3:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8](=[O:15])[n:9]([CH2:12][CH:13]=[O:14])[c:10]2[cH:11]1.[CH3:65][C:66](=[O:67])[OH:68].[CH:60]([Cl:61])([Cl:62])[Cl:63].[Cl:69][CH2:70][Cl:71].[Na+:54].[Na+:59].[O:16]1[CH2:17][CH2:18][O:19][c:20]2[c:21]1[cH:22][cH:23][c:24]([CH2:26][N:27]([C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH:35]1[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]1)[cH:25]2.[OH2:64]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][cH:7][c:8](=[O:15])[n:9]([CH2:12][CH2:13][N:38]3[CH2:37][CH2:36][CH:35]([N:27]([CH2:26][c:24]4[cH:23][cH:22][c:21]5[c:20]([cH:25]4)[O:19][CH2:18][CH2:17][O:16]5)[C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH2:40][CH2:39]3)[c:10]2[cH:11]1
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 962WaterHCID 6212ChloroformHCID 6344DichloromethaneHCID 2724942Triacetoxyborohydride
HCID 57815320
Tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(piperidin-4-yl)carbamate
HCID 59398276(7-methyl-2-oxoquinolin-1(2H)-yl)acetaldehyde

생성물 1

HCID 59398272tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(7-methyl-2-oxoquinolin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate

출처 및 근거

ORD 기록
ord-1ab81c335ac14fcdaf604a1836ab8c57
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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