1,4-Dioxane → Diglycolic Acid

HRID 214504

반응식

HRID 214504 반응식
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([C:7]([O:8][CH2:9][C:10]([CH2:11][OH:12])([C:13]([O:14][CH2:15][CH3:16])=[O:17])[C:18]([O:19][CH2:20][CH3:21])=[O:22])([c:23]2[cH:24][cH:25][c:26]([O:27][CH3:28])[cH:29][cH:30]2)[c:31]2[cH:32][cH:33][c:34]([O:35][CH3:36])[cH:37][cH:38]2)[cH:39][cH:40]1.[O:41]1[C:42](=[O:48])[CH2:43][O:44][CH2:45][C:46]1=[O:47].[O:49]1[CH2:50][CH2:51][O:52][CH2:53][CH2:54]1>>[O:2]=[C:42]([CH2:43][O:44][CH2:45][C:46]([OH:41])=[O:47])[OH:48]

참가 물질

4

반응물 3

HCID 312751,4-DioxaneHCID 782321,4-Dioxane-2,6-dioneHCID 15539820Diethyl 2-[(4,4',4''-trimethoxytrityl)oxymethyl]-2-hydroxymethylmalonate

생성물 1

HCID 8088Diglycolic Acid

출처 및 근거

ORD 기록
ord-8e5e05b143f34c00a37ca7386921258c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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