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Ethanol → 3-{[(4-{[(5-Chloro-3-methylfuro[3,2-b]pyridin-2-yl)(cyclohexyl)methyl]amino}phenyl)carbonyl]amino}propanoic acid

HRID 2146076
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인쇄 미리보기

반응식

HRID 2146076 반응식
[CH3:43][CH2:44][OH:45].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[c:8]([CH3:35])[c:9]([CH:11]([CH:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1)[NH:18][c:19]1[cH:20][cH:21][c:22]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:23][cH:24]1)[o:10]2.[Na+:42].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH-:41]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7]1)[c:8]([CH3:35])[c:9]([CH:11]([CH:12]1[CH2:13][CH2:14][CH2:15][CH2:16][CH2:17]1)[NH:18][c:19]1[cH:20][cH:21][c:22]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][C:30](=[O:31])[OH:32])[cH:23][cH:24]1)[o:10]2
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 8028TetrahydrofuranHCID 86662748Ethyl 3-{[(4-{[(5-chloro-3-methylfuro[3,2-b]pyridin-2-yl)(cyclohexyl)methyl]amino}phenyl)carbonyl]amino}propanoate

생성물 1

HCID 866729043-{[(4-{[(5-Chloro-3-methylfuro[3,2-b]pyridin-2-yl)(cyclohexyl)methyl]amino}phenyl)carbonyl]amino}propanoic acid

출처 및 근거

ORD 기록
ord-f0e9c38c676243fba0beef3faf5acc86
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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