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Acetic Acid → N-(8-propyl-8-azabicyclo[3.2.1]oct-3-yl)-1-tetrahydro-2H-pyran-2-yl-1H-indazol-5-amine

HRID 1147943
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인쇄 미리보기

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HRID 1147943 반응식
[C:1]([BH3-:2])#[N:3].[C:25]([NH:26][c:27]1[c:28]([CH3:29])[cH:30][c:31]([C:32]([O:33][CH3:34])=[O:35])[c:36]([CH3:37])[cH:38]1)(=[O:39])[CH3:40].[CH2:41]([CH2:42][CH3:43])[N:44]1[CH:45]2[CH2:46][C:47](=[O:52])[CH2:48][CH:49]1[CH2:50][CH2:51]2.[CH3:54][OH:55].[CH3:5][C:6](=[O:7])[OH:8].[NH3:53].[Na+:4].[O:9]1[CH:10]([n:15]2[n:16][cH:17][c:18]3[cH:19][c:20]([NH2:24])[cH:21][cH:22][c:23]23)[CH2:11][CH2:12][CH2:13][CH2:14]1>>[O:9]1[CH:10]([n:15]2[n:16][cH:17][c:18]3[cH:19][c:20]([NH:24][CH:47]4[CH2:46][CH:45]5[N:44]([CH2:41][CH2:42][CH3:43])[CH:49]([CH2:48]4)[CH2:50][CH2:51]5)[cH:21][cH:22][c:23]23)[CH2:11][CH2:12][CH2:13][CH2:14]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 176Acetic AcidHCID 222AmmoniaHCID 887MethanolHCID 923Sodium IonHCID 327521Methyl 4-acetamido-2,5-dimethylbenzoateHCID 498716Cyano-borohydrideHCID 229339271-(Oxan-2-yl)-1H-indazol-5-amine
HCID 23383579
8-Propyl-8-azabicyclo[3.2.1]octan-3-one

생성물 1

HCID 18447446N-(8-propyl-8-azabicyclo[3.2.1]oct-3-yl)-1-tetrahydro-2H-pyran-2-yl-1H-indazol-5-amine

출처 및 근거

ORD 기록
ord-5c3ce1964aa04643b27c5fef7268c4ec
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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