Htris → 4-Bromo-5-methyl-1H-pyrrole-2-carboxylic acid

HRID 2314340

반응식

HRID 2314340 반응식
[Br:35][c:36]1[cH:37][c:38]([C:42](=[O:43])[O:44][CH2:45][CH3:46])[nH:39][c:40]1[CH3:41].[Cl:1][c:2]1[c:3]([Cl:4])[c:5]([CH3:6])[nH:7][c:8]1[C:9]([NH:10][CH:11]1[CH2:12][CH2:13][N:14]([c:15]2[s:16][c:17]([C:18]([O-:19])=[O:20])[cH:21][n:22]2)[CH2:23][CH:24]1[F:25])=[O:26].[OH:27][CH2:28][C:29]([CH2:30][OH:31])([NH3+:32])[CH2:33][OH:34]>>[Br:35][c:36]1[cH:37][c:38]([C:42](=[O:43])[OH:44])[nH:39][c:40]1[CH3:41]

참가 물질

4

반응물 3

HCID 3777159HtrisHCID 58066105Ethyl 4-bromo-5-methyl-1H-pyrrole-2-carboxylateHCID 178433655HCID 178433655, 화합물

생성물 1

HCID 685182224-Bromo-5-methyl-1H-pyrrole-2-carboxylic acid

출처 및 근거

ORD 기록
ord-29cd5bed8290412ea3953962b78dbbd6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

연결된 노트

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