Cuminaldehyde → HCID 3583733, 화합물

반응식

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

참가 물질

반응물 3

HCID 326Cuminaldehyde

HCID 1150Tryptamine

HCID 6422Trifluoroacetic acid

생성물 1

HCID 3583733HCID 3583733, 화합물

출처 및 근거

ORD 기록: ord-450e4cfce87f4301b8835ce0dc0e67f4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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