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Hydroxide → 8-[2-[(4-Tert-butylphenyl)methoxy]phenyl]-6-[2-(4-cyanophenyl)ethyl]oct-7-enoic acid

HRID 2140574
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HRID 2140574 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][O:10][c:11]2[c:12]([CH:17]=[CH:18][CH:19]([CH2:20][CH2:21][CH2:22][CH2:23][C:24](=[O:25])[O:26][CH2:27][CH3:28])[CH2:29][CH2:30][c:31]3[cH:32][cH:33][c:34]([C:37]#[N:38])[cH:35][cH:36]3)[cH:13][cH:14][cH:15][cH:16]2)[cH:39][cH:40]1.[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:43][CH2:44][O:45][CH2:46][CH3:47].[Li+:41].[OH-:42].[OH2:53]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][O:10][c:11]2[c:12]([CH:17]=[CH:18][CH:19]([CH2:20][CH2:21][CH2:22][CH2:23][C:24](=[O:25])[OH:26])[CH2:29][CH2:30][c:31]3[cH:32][cH:33][c:34]([C:37]#[N:38])[cH:35][cH:36]3)[cH:13][cH:14][cH:15][cH:16]2)[cH:39][cH:40]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 961HydroxideHCID 962WaterHCID 3283Diethyl EtherHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 67350659Ethyl 8-[2-[(4-tert-butylphenyl)methoxy]phenyl]-6-[2-(4-cyanophenyl)ethyl]oct-7-enoate

생성물 1

HCID 67352747
8-[2-[(4-Tert-butylphenyl)methoxy]phenyl]-6-[2-(4-cyanophenyl)ethyl]oct-7-enoic acid

출처 및 근거

ORD 기록
ord-91318ef7cf1545799150259b25cb0e55
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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