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Pyridine → 2-({4-[6-Methoxy-7-methyl-3-oxo-4-(2-trimethylsilanyl-ethoxy)-1,3-dihydro-isobenzofuran-5-yl]-2-methyl-but-2-enyl}-phenoxy-phosphinoyloxy)-propionic Acid Ethyl Ester

HRID 167231
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HRID 167231 반응식
[C:36]([CH:37]([OH:38])[CH3:39])(=[O:40])[O:41][CH2:42][CH3:43].[P-:44]([F:45])([F:46])([F:47])([F:48])([F:49])[F:50].[c:1]1([O:7][P:8]([OH:9])(=[O:10])[CH2:11][C:12](=[CH:13][CH2:14][c:15]2[c:16]([O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[c:17]3[c:21]([c:22]([CH3:26])[c:23]2[O:24][CH3:25])[CH2:20][O:19][C:18]3=[O:27])[CH3:35])[cH:2][cH:3][cH:4][cH:5][cH:6]1.[cH:77]1[cH:78][cH:79][n:80][cH:81][cH:82]1.[n:51]1([O:52][P+:53]([N:54]2[CH2:55][CH2:56][CH2:57][CH2:58]2)([N:59]2[CH2:60][CH2:61][CH2:62][CH2:63]2)[N:64]2[CH2:65][CH2:66][CH2:67][CH2:68]2)[c:69]2[cH:70][cH:71][cH:72][cH:73][c:74]2[n:75][n:76]1>>[c:1]1([O:7][P:8](=[O:9])([O:10][CH:37]([C:36](=[O:40])[O:41][CH2:42][CH3:43])[CH3:39])[CH2:11][C:12](=[CH:13][CH2:14][c:15]2[c:16]([O:28][CH2:29][CH2:30][Si:31]([CH3:32])([CH3:33])[CH3:34])[c:17]3[c:21]([c:22]([CH3:26])[c:23]2[O:24][CH3:25])[CH2:20][O:19][C:18]3=[O:27])[CH3:35])[cH:2][cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 1049PyridineHCID 7344Ethyl LactateHCID 9886HexafluorophosphateHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphoniumHCID 76548829{4-[6-Methoxy-7-methyl-3-oxo-4-(2-trimethylsilanyl-ethoxy)-1,3-dihydro-isobenzofuran-5-yl]-2-methyl-but-2-enyl}-phosphonic Acid Monophenyl Ester

생성물 1

HCID 76546202
2-({4-[6-Methoxy-7-methyl-3-oxo-4-(2-trimethylsilanyl-ethoxy)-1,3-dihydro-isobenzofuran-5-yl]-2-methyl-but-2-enyl}-phenoxy-phosphinoyloxy)-propionic Acid Ethyl Ester

출처 및 근거

ORD 기록
ord-f5f0cd7dcb224f43b60145b0176f891e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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