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Sodium Ion → 13-methyl-3-phenylmethoxy-7-propyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one

HRID 119747
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HRID 119747 반응식
[CH3:34][C:35]1([CH3:44])[N:36]([O:37])[C:38]([CH3:39])([CH3:40])[CH2:41][CH2:42][CH2:43]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:1][O-:2].[Na+:3].[OH2:45].[c:4]1([CH2:10][O:11][c:12]2[cH:13][c:14]3[c:27]([cH:28][cH:29]2)[CH:26]2[CH:17]([CH:16]([CH2:31][CH2:32][CH3:33])[CH2:15]3)[CH:18]3[CH2:19][CH2:20][CH:21]([OH:30])[C:22]3([CH3:23])[CH2:24][CH2:25]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1>>[c:4]1([CH2:10][O:11][c:12]2[cH:13][c:14]3[c:27]([cH:28][cH:29]2)[CH:26]2[CH:17]([CH:16]([CH2:31][CH2:32][CH3:33])[CH2:15]3)[CH:18]3[CH2:19][CH2:20][C:21](=[O:30])[C:22]3([CH3:23])[CH2:24][CH2:25]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1
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7

반응물 6

HCID 923Sodium IonHCID 962WaterHCID 8857Ethyl AcetateHCID 61739HypochloriteHCID 5499762,2,6,6-Tetramethylpiperidin-1-olHCID 7234374813-Methyl-3-phenylmethoxy-7-propyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol

생성물 1

HCID 72343747
13-methyl-3-phenylmethoxy-7-propyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one

출처 및 근거

ORD 기록
ord-a2d25aa55d4540969148dd9d32eec2bc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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