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Tetrahydrofuran → Ethyl(({1-[(cyclohexylamino)carbonyl]piperidin-4-yl}methyl){4-[(dodecylamino)carbonyl]benzyl}amino)(oxo)acetate

HRID 816954
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반응식

HRID 816954 반응식
[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[N:7]([CH2:8][CH:9]1[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]1)[CH2:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[NH:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[cH:20][cH:21]1)=[O:37].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[O:38]=[C:39]=[N:40][CH:41]1[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1>>[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[N:7]([CH2:8][CH:9]1[CH2:10][CH2:11][N:12]([C:39](=[O:38])[NH:40][CH:41]2[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[CH2:13][CH2:14]1)[CH2:15][c:16]1[cH:17][cH:18][c:19]([C:22](=[O:23])[NH:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[cH:20][cH:21]1)=[O:37]
참가 물질출처 및 근거반응 노트

참가 물질

4

반응물 3

HCID 8028TetrahydrofuranHCID 18502Cyclohexyl isocyanateHCID 67186073Ethyl[{4-[(dodecylamino)carbonyl]benzyl}(piperidin-4-ylmethyl)amino](oxo)acetate

생성물 1

HCID 67186835Ethyl(({1-[(cyclohexylamino)carbonyl]piperidin-4-yl}methyl){4-[(dodecylamino)carbonyl]benzyl}amino)(oxo)acetate

출처 및 근거

ORD 기록
ord-6a039c9df230477f8d4254fe20f350da
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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