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Dichloromethane → HCID 56949456, 화합물

HRID 2324806
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HRID 2324806 반응식
[CH:44]([N:45]([CH2:46][CH3:47])[CH:48]([CH3:49])[CH3:50])([CH3:51])[CH3:52].[Cl:87][CH2:88][Cl:89].[NH2:53][c:54]1[cH:55][c:56](-[c:60]2[n:61][c:62]3[cH:63][cH:64][cH:65][cH:66][c:67]3[c:68]([NH:70][c:71]3[cH:72][c:73]4[cH:74][n:75][n:76]([C:80](=[O:81])[O:82][C:83]([CH3:84])([CH3:85])[CH3:86])[c:77]4[cH:78][cH:79]3)[n:69]2)[cH:57][cH:58][cH:59]1.[O:1]1[CH2:2][CH2:3][N:4]([CH2:7][C:8](=[O:9])[OH:10])[CH2:5][CH2:6]1.[P-:11]([F:12])([F:13])([F:14])([F:15])([F:16])[F:17].[n:18]1([O:19][P+:20]([N:21]2[CH2:22][CH2:23][CH2:24][CH2:25]2)([N:26]2[CH2:27][CH2:28][CH2:29][CH2:30]2)[N:31]2[CH2:32][CH2:33][CH2:34][CH2:35]2)[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[O:1]1[CH2:2][CH2:3][N:4]([CH2:7][C:8](=[O:10])[NH:53][c:54]2[cH:55][c:56](-[c:60]3[n:61][c:62]4[cH:63][cH:64][cH:65][cH:66][c:67]4[c:68]([NH:70][c:71]4[cH:72][c:73]5[cH:74][n:75][n:76]([C:80](=[O:81])[O:82][C:83]([CH3:84])([CH3:85])[CH3:86])[c:77]5[cH:78][cH:79]4)[n:69]3)[cH:57][cH:58][cH:59]2)[CH2:5][CH2:6]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4389684-Morpholineacetic acidHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphoniumHCID 66825994tert-butyl 5-(2-(3-aminophenyl)quinazolin-4-ylamino)-1H-indazole-1-carboxylate

생성물 1

HCID 56949456
HCID 56949456, 화합물

출처 및 근거

ORD 기록
ord-9482c4e79e454de4b621fde1f7919d90
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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