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Dichloromethane → Methyl 5-(4-(2-((tert-butoxycarbonylamino)methyl)-5-fluorobenzamido)-N-methylbutylsulfonamido)-8-(tosyloxy)-1,6-naphthyridine-7-carboxylate

HRID 308802
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반응식

HRID 308802 반응식
[C:69]([CH3:70])([CH3:71])([CH3:72])[O:73][C:74](=[O:75])[NH:76][CH2:77][c:78]1[c:79]([C:80](=[O:81])[OH:82])[cH:83][c:84]([F:87])[cH:85][cH:86]1.[CH:36]([N:37]([CH2:38][CH3:39])[CH:40]([CH3:41])[CH3:42])([CH3:43])[CH3:44].[Cl:88][CH2:89][Cl:90].[NH2:1][CH2:2][CH2:3][CH2:4][CH2:5][S:6](=[O:7])(=[O:8])[N:9]([CH3:10])[c:11]1[c:12]2[cH:13][cH:14][cH:15][n:16][c:17]2[c:18]([O:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH3:33])[cH:34][cH:35]2)[c:19]([C:21](=[O:22])[O:23][CH3:24])[n:20]1.[P-:45]([F:46])([F:47])([F:48])([F:49])([F:50])[F:51].[n:52]1([O:53][C:54]([N:55]([CH3:56])[CH3:57])=[N+:58]([CH3:59])[CH3:60])[c:61]2[cH:62][cH:63][cH:64][cH:65][c:66]2[n:67][n:68]1>>[NH:1]([CH2:2][CH2:3][CH2:4][CH2:5][S:6](=[O:7])(=[O:8])[N:9]([CH3:10])[c:11]1[c:12]2[cH:13][cH:14][cH:15][n:16][c:17]2[c:18]([O:25][S:26](=[O:27])(=[O:28])[c:29]2[cH:30][cH:31][c:32]([CH3:33])[cH:34][cH:35]2)[c:19]([C:21](=[O:22])[O:23][CH3:24])[n:20]1)[C:80]([c:79]1[c:78]([CH2:77][NH:76][C:74]([O:73][C:69]([CH3:70])([CH3:71])[CH3:72])=[O:75])[cH:86][cH:85][c:84]([F:87])[cH:83]1)=[O:81]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 110654742-[[(tert-Butoxycarbonyl)amino]methyl]-5-fluorobenzoic acidHCID 86667516Methyl 5-(4-amino-N-methylbutylsulfonamido)-8-(tosyloxy)-1,6-naphthyridine-7-carboxylate

생성물

1
HCID 86667517Methyl 5-(4-(2-((tert-butoxycarbonylamino)methyl)-5-fluorobenzamido)-N-methylbutylsulfonamido)-8-(tosyloxy)-1,6-naphthyridine-7-carboxylate

출처 및 근거

ORD 기록
ord-5db53d5f124b41668a63c9a91f81e11a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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