Phosphate → (-)-5-Decyloxy-2-[4-(6-hydroxyheptenyl)phenyl]pyrimidine

반응식

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

참가 물질

반응물 3

HCID 1061Phosphate

HCID 6212Chloroform

HCID 545677957-[4-(5-Decoxypyrimidin-2-yl)phenyl]hept-6-en-2-yl acetate

생성물 1

HCID 53726462(-)-5-Decyloxy-2-[4-(6-hydroxyheptenyl)phenyl]pyrimidine

출처 및 근거

ORD 기록: ord-cbce9ea4aa584ef9b9b37a8b6fb32cc9
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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