Methyl 4-amino-3-methylbenzoate → 5-Carboxy-2-(3-methyl-n-butyl)indole

반응식

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

참가 물질

반응물 2

HCID 2736799Methyl 4-amino-3-methylbenzoate

HCID 187616275-Carboxy-2-(2-methyl-1-buten-4-yl)indole

생성물 1

HCID 187616325-Carboxy-2-(3-methyl-n-butyl)indole

출처 및 근거

ORD 기록: ord-2837465910134b6a88bdde3da1fa70b2
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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