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Tetrahydrofuran → 2-(1-Ethoxycarbonyl-2-vinyl-cyclopropylcarbamoyl)-4-(7-methoxy-2-phenyl-quinazolin-4-yloxy)-cyclopentanecarboxylic acid tert-butyl ester

HRID 1239352
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HRID 1239352 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH:8]1[CH:9]([C:14]([NH:15][C:16]2([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH:17]([CH:19]=[CH2:20])[CH2:18]2)=[O:26])[CH2:10][CH:11]([OH:13])[CH2:12]1.[CH2:65]1[O:66][CH2:67][CH2:68][CH2:69]1.[CH3:27][O:28][c:29]1[cH:30][cH:31][c:32]2[c:33]([OH:45])[n:34][c:35](-[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[n:36][c:37]2[cH:38]1.[c:46]1([P:47]([c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)[cH:60][cH:61][cH:62][cH:63][cH:64]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[CH:8]1[CH:9]([C:14]([NH:15][C:16]2([C:21](=[O:22])[O:23][CH2:24][CH3:25])[CH:17]([CH:19]=[CH2:20])[CH2:18]2)=[O:26])[CH2:10][CH:11]([O:13][c:33]2[c:32]3[cH:31][cH:30][c:29]([O:28][CH3:27])[cH:38][c:37]3[n:36][c:35](-[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[n:34]2)[CH2:12]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 668714182-(1-Ethoxycarbonyl-2-vinylcyclopropylcarbamoyl)-4-hydroxycyclopentanecarboxylic acid tert-butyl esterHCID 178487727HCID 178487727, 화합물

생성물 1

HCID 684230722-(1-Ethoxycarbonyl-2-vinyl-cyclopropylcarbamoyl)-4-(7-methoxy-2-phenyl-quinazolin-4-yloxy)-cyclopentanecarboxylic acid tert-butyl ester

출처 및 근거

ORD 기록
ord-e2dc1b85ef1446718cd15fb98db7208c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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