Chem
J-GLOBAL ID:200907098805695218
Nikkaji number:J850.947F
(1S,3R,6R,8R)-3-(4-Fluorophenyl)-8-[4-(hexyloxy)phenyl]-2,4,7-trioxabicyclo[4.4.0]decane
(1S,3R,6R,8R)-3-(4-フルオロフェニル)-8-[4-(ヘキシルオキシ)フェニル]-2,4,7-トリオキサビシクロ[4.4.0]デカン
Download MOL file
Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C25 H31 FO4
Molecular formula furigana:
C25-H31-F-O4
Molecular weight:
414.517
InChI:
InChI=1S/C25H31FO4/c1-2-3-4-5-16-27-21-12-8-18(9-13-21)22-14-15-23-24(29-22)17-28-25(30-23)19-6-10-20(26)11-7-19/h6-13,22-25H,2-5,14-17H2,1H3/t22-,23+,24-,25-/m1/s1
InChI key:
HWVNXYSPRQIWNO-ZFFYZDHPSA-N
SMILES:
CCCCCCOc1ccc(cc1)[C@H]1CC[C@@H]2O[C@@H](OC[C@H]2O1)c1ccc(F)cc1
Systematic name (3):
(1S,3R,6R,8R)-3-(4-フルオロフェニル)-8-[4-(ヘキシルオキシ)フェニル]-2,4,7-トリオキサビシクロ[4.4.0]デカン
(2R,4aR,6R,8aS)-2-(4-フルオロフェニル)-6-[4-(ヘキシルオキシ)フェニル]-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン
(2R,4aR,6R,8aS)-2-(4-fluorophenyl)-6-[4-(hexyloxy)phenyl]-hexahydro-2H-pyrano[3,2-d][1,3]dioxine
Other name (1):
(1S,3R,6R,8R)-3-(4-Fluorophenyl)-8-[4-(hexyloxy)phenyl]-2,4,7-trioxabicyclo[4.4.0]decane
Thsaurus map:
Return to Previous Page