Methanol → 4-(2,3,4-TRIMETHOXYPHENYL)-4-OXOBUTYRIC ACID

HRID 1149403

반응식

HRID 1149403 반응식
[CH3:24][OH:25].[CH3:3][O:4][C:5]([CH2:6][CH2:7][C:8]([c:9]1[c:10]([O:19][CH3:20])[c:11]([O:17][CH3:18])[c:12]([O:15][CH3:16])[cH:13][cH:14]1)=[O:21])=[O:22].[Na+:2].[OH-:1].[OH2:23]>>[O:4]=[C:5]([CH2:6][CH2:7][C:8]([c:9]1[c:10]([O:19][CH3:20])[c:11]([O:17][CH3:18])[c:12]([O:15][CH3:16])[cH:13][cH:14]1)=[O:21])[OH:22]

참가 물질

6

반응물 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 447204584-Oxo-4-(2,3,4-trimethoxy-phenyl)-butyric acid methyl ester

생성물 1

HCID 109454324-(2,3,4-TRIMETHOXYPHENYL)-4-OXOBUTYRIC ACID

출처 및 근거

ORD 기록
ord-f3f76548b0be43c1bae46212e92d4654
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

연결된 노트

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