4-Oxo-4,5,6,7-tetrahydrobenzofuran-2-carboxylic acid → HCID 67401881, 화합물

HRID 109631

반응식

HRID 109631 반응식
[CH3:1][c:2]1[c:3]([NH2:19])[cH:4][cH:5][c:6]([N:8]2[CH2:9][CH:10]([N:13]3[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]3)[CH2:11][CH2:12]2)[cH:7]1.[O:20]=[C:21]1[CH2:22][CH2:23][CH2:24][c:25]2[c:26]1[cH:27][c:28]([C:30](=[O:31])[OH:32])[o:29]2>>[CH3:1][c:2]1[c:3]([NH:19][C:30]([c:28]2[cH:27][c:26]3[c:25]([o:29]2)[CH2:24][CH2:23][CH2:22][C:21]3=[O:20])=[O:31])[cH:4][cH:5][c:6]([N:8]2[CH2:9][CH:10]([N:13]3[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]3)[CH2:11][CH2:12]2)[cH:7]1

참가 물질

3

반응물 2

HCID 34710084-Oxo-4,5,6,7-tetrahydrobenzofuran-2-carboxylic acidHCID 594018302-Methyl-4-(2-methyl-[1,3']bipyrrolidinyl-1'-yl)-phenylamine

생성물 1

HCID 67401881HCID 67401881, 화합물

출처 및 근거

ORD 기록
ord-918584a8ec584019baf657055bd053e5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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