Acetic Acid → HCID 59354866, 화합물

HRID 126432노트

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HRID 126432 반응식
[C:36]([OH:37])(=[O:38])[CH3:39].[CH3:1][C:2]1([CH3:35])[O:3][C:4]([c:26]2[cH:27][cH:28][c:29]([N+:32]([O-:33])=[O:34])[cH:30][cH:31]2)=[C:5]([c:8]2[cH:9][cH:10][c:11]([O:14][CH2:15][c:16]3[n:17][c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]4[cH:24][cH:25]3)[cH:12][cH:13]2)[C:6]1=[O:7].[CH3:40][CH2:41][OH:42]>>[CH3:1][C:2]1([CH3:35])[O:3][C:4]([c:26]2[cH:27][cH:28][c:29]([NH2:32])[cH:30][cH:31]2)=[C:5]([c:8]2[cH:9][cH:10][c:11]([O:14][CH2:15][c:16]3[n:17][c:18]4[cH:19][cH:20][cH:21][cH:22][c:23]4[cH:24][cH:25]3)[cH:12][cH:13]2)[C:6]1=[O:7]

참가 물질

4

반응물 3

HCID 176Acetic AcidHCID 702EthanolHCID 593548082,2-dimethyl-5-(4-nitrophenyl)-4-(4-(quinolin-2-ylmethoxy)phenyl)furan-3(2H)-one

생성물 1

HCID 59354866HCID 59354866, 화합물

출처 및 근거

ORD 기록
ord-c9b66e1a96674ffbab48b2eed1e345ff
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

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