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Sodium Ion → HCID 53972041, 화합물

HRID 112700
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HRID 112700 반응식
[CH2:27]([CH2:28][CH3:29])[c:30]1[cH:31][cH:32][c:33]([CH:36]2[CH2:37][CH2:38][CH:39]([OH:42])[CH2:40][CH2:41]2)[cH:34][cH:35]1.[CH2:7]([CH2:8][CH2:9][CH2:10][CH3:11])[CH:12]1[CH2:13][CH2:14][CH:15]([CH:18]2[CH2:19][CH2:20][CH:21]([C:24](=[O:25])[OH:26])[CH2:22][CH2:23]2)[CH2:16][CH2:17]1.[CH3:49][C:50]#[N:51].[CH3:58][N:59]([CH3:60])[CH:61]=[O:62].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Na+:43].[Na+:44].[O-:45][C:46](=[O:47])[O-:48].[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1>>[CH2:7]([CH2:8][CH2:9][CH2:10][CH3:11])[CH:12]1[CH2:13][CH2:14][CH:15]([CH:18]2[CH2:19][CH2:20][CH:21]([C:24]([O:25][CH:39]3[CH2:38][CH2:37][CH:36]([c:33]4[cH:32][cH:31][c:30]([CH2:27][CH2:28][CH3:29])[cH:35][cH:34]4)[CH2:41][CH2:40]3)=[O:26])[CH2:22][CH2:23]2)[CH2:16][CH2:17]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 923Sodium Ion2회HCID 1049PyridineHCID 6228DimethylformamideHCID 6342AcetonitrileHCID 19660Carbonate IonHCID 65578Oxalyl chlorideHCID 1712164(trans,trans)-4'-Pentyl-(1,1'-bicyclohexyl)-4-carboxylic acid
HCID 20275771
4-(4-Propylphenyl)cyclohexan-1-ol

생성물 1

HCID 53972041HCID 53972041, 화합물

출처 및 근거

ORD 기록
ord-a20e44a1e048448bbf957a48cd12bd4b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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