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Formaldehyde → HCID 178424592, 화합물

HRID 157677
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HRID 157677 반응식
[C:40](=[O:41])([O-:42])[OH:43].[CH2:1]=[O:2].[CH2:34]([C:35]#[CH:36])[OH:37].[CH2:45]1[O:46][CH2:47][CH2:48][O:49][CH2:50]1.[Cu+2:61].[F:3][C:4]([c:5]1[cH:6][c:7]([C:8](=[O:9])[N:10]2[CH:11]([CH2:16][c:17]3[cH:18][c:19]([CH3:24])[c:20]([CH3:23])[cH:21][cH:22]3)[CH2:12][NH:13][CH2:14][CH2:15]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33].[I-:39].[K+:38].[Na+:44].[OH2:51].[OH2:52].[OH2:53].[OH2:54].[OH2:55].[S:56]([O-:57])([O-:58])(=[O:59])=[O:60]>>[F:3][C:4]([c:5]1[cH:6][c:7]([C:8](=[O:9])[N:10]2[CH:11]([CH2:16][c:17]3[cH:18][c:19]([CH3:24])[c:20]([CH3:23])[cH:21][cH:22]3)[CH2:12][N:13]([CH2:40][C:36]#[C:35][CH2:34][OH:37])[CH2:14][CH2:15]2)[cH:25][c:26]([C:28]([F:29])([F:30])[F:31])[cH:27]1)([F:32])[F:33]
참가 물질출처 및 근거반응 노트

참가 물질

12

반응물 11

HCID 712FormaldehydeHCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium IonHCID 962Water5회HCID 1117Sulfate IonHCID 7859Propargyl alcoholHCID 27099Cupric cation
HCID 30165
Iodide Ion
HCID 312751,4-Dioxane
HCID 18703556[3,5-Bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]piperazin-1-yl]methanone

생성물 1

HCID 178424592HCID 178424592, 화합물

출처 및 근거

ORD 기록
ord-b4ae31c5f0f249fcbe395f6680d075a4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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