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Hydrochloric Acid → 4-(3-Cyclopentyloxy-4-methoxyphenyl)-4-[2-[4-(2-hydroxyethoxy)phenyl]ethynyl]cyclohexan-1-one

HRID 118232
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반응식

HRID 118232 반응식
[CH:1]1([O:6][c:7]2[cH:8][c:9]([C:15]3([C:25]#[C:26][c:27]4[cH:28][cH:29][c:30]([O:33][CH2:34][CH2:35][OH:36])[cH:31][cH:32]4)[CH2:16][CH2:17][C:18]4([CH2:19][CH2:20]3)[O:21][CH2:24][CH2:23][O:22]4)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1.[ClH:37].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH2:38]>>[CH:1]1([O:6][c:7]2[cH:8][c:9]([C:15]3([C:25]#[C:26][c:27]4[cH:28][cH:29][c:30]([O:33][CH2:34][CH2:35][OH:36])[cH:31][cH:32]4)[CH2:16][CH2:17][C:18](=[O:21])[CH2:19][CH2:20]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1
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참가 물질

5

반응물 4

HCID 313Hydrochloric AcidHCID 962WaterHCID 8028TetrahydrofuranHCID 541798624-(3-Cyclopentyloxy-4-methoxyphenyl)-4-(2-[4-(2-hydroxyethan-1-oxy)phenyl]ethynyl)-1,1-(ethylenedioxy)cyclohexane

생성물 1

HCID 543161004-(3-Cyclopentyloxy-4-methoxyphenyl)-4-[2-[4-(2-hydroxyethoxy)phenyl]ethynyl]cyclohexan-1-one

출처 및 근거

ORD 기록
ord-699bb4b8f91f4ab2ae773d236453639a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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