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Ethanol → 3-methoxy-13-methyl-17-methylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene

HRID 1567501
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인쇄 미리보기

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HRID 1567501 반응식
[C:21](=[O:22])([O-:23])[O-:24].[CH2:1]=[C:2]1[C:3]2([CH3:4])[CH:5]([CH2:6][CH2:7]1)[CH:8]1[CH2:9][CH2:10][c:11]3[cH:12][c:13]([OH:20])[cH:14][cH:15][c:16]3[CH:17]1[CH2:18][CH2:19]2.[CH3:27][O:28][S:29]([O:30][CH3:31])(=[O:32])=[O:33].[CH3:35][CH2:36][OH:37].[K+:25].[K+:26].[OH2:34]>>[CH2:1]=[C:2]1[C:3]2([CH3:4])[CH:5]([CH2:6][CH2:7]1)[CH:8]1[CH2:9][CH2:10][c:11]3[cH:12][c:13]([O:20][CH3:21])[cH:14][cH:15][c:16]3[CH:17]1[CH2:18][CH2:19]2
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참가 물질

7

반응물 6

HCID 702EthanolHCID 813Potassium Cation2회HCID 962WaterHCID 6497Dimethyl SulfateHCID 19660Carbonate IonHCID 1445855113-Methyl-17-methylene-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-ol

생성물 1

HCID 144585543-methoxy-13-methyl-17-methylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene

출처 및 근거

ORD 기록
ord-643b3a03a2504627a80b2f655835c20e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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