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Ammonium → 3-[[1-(carboxy)-3-phenyl-propyl]amino]-1-t-butoxycarbonylmethyl-2,3,4,5-tetrahydro-1H-benzazepin-2-one

HRID 816281
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인쇄 미리보기

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HRID 816281 반응식
[C:1]([CH:2]=[CH:3][C:4]([O:5][CH2:6][CH3:7])=[O:8])(=[O:9])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[C:37]([CH3:38])([CH3:39])([CH3:40])[O:41][C:42]([CH2:43][N:44]1[c:45]2[c:46]([cH:65][cH:66][cH:67][cH:68]2)[CH2:47][CH2:48][CH:49]([NH:52][CH:53]2[C:54](=[O:64])[O:55][CH:56]([c:58]3[cH:59][cH:60][cH:61][cH:62][cH:63]3)[CH2:57]2)[C:50]1=[O:51])=[O:69].[CH3:74][c:75]1[cH:76][cH:77][cH:78][cH:79][cH:80]1.[CH:70]([O-:71])=[O:72].[NH2:16][CH:17]1[CH2:18][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]2[N:26]([CH2:27][C:28]([O:29][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:34])[C:35]1=[O:36].[NH4+:73]>>[C:37]([CH3:38])([CH3:39])([CH3:40])[O:41][C:42]([CH2:43][N:44]1[c:45]2[c:46]([cH:65][cH:66][cH:67][cH:68]2)[CH2:47][CH2:48][CH:49]([NH:52][CH:53]([C:54](=[O:55])[OH:64])[CH2:57][CH2:56][c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[C:50]1=[O:51])=[O:69]
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참가 물질

7

반응물 6

HCID 223AmmoniumHCID 283FormateHCID 1140TolueneHCID 5698852-Butenoic acid, 4-oxo-4-phenyl-, ethyl esterHCID 36741653-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetateHCID 85122760[2-Oxo-3-(2-oxo-5-phenyl-tetrahydro-furan-3-ylamino)-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl]-acetic acid tert-butyl ester

생성물

1
HCID 222629803-[[1-(carboxy)-3-phenyl-propyl]amino]-1-t-butoxycarbonylmethyl-2,3,4,5-tetrahydro-1H-benzazepin-2-one

출처 및 근거

ORD 기록
ord-b06bc46ddf244ef4b433807b3fcfd196
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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