Chem
J-GLOBAL ID：200907071984992038   Nikkaji number：J850.962J

(1S,3R,6R)-3-[4-[4-(Octyloxy)benzoyloxy]phenyl]-2,4,7-trioxabicyclo[4.4.0]decane

(1S,3R,6R)-3-[4-[4-(オクチルオキシ)ベンゾイルオキシ]フェニル]-2,4,7-トリオキサビシクロ[4.4.0]デカン
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： C28H36O6
Molecular formula furigana： C28-H36-O6
Molecular weight： 468.590
InChI： InChI=1S/C28H36O6/c1-2-3-4-5-6-7-18-30-23-14-10-21(11-15-23)27(29)33-24-16-12-22(13-17-24)28-32-20-26-25(34-28)9-8-19-31-26/h10-17,25-26,28H,2-9,18-20H2,1H3/t25-,26+,28+/m0/s1
InChI key： CQEQCULFIDJKDU-ZRRKCSAHSA-N
SMILES： CCCCCCCCOc1ccc(cc1)C(=O)Oc1ccc(cc1)[C@@H]1OC[C@H]2OCCC[C@@H]2O1
Systematic name  (3)：
  • (1S,3R,6R)-3-[4-[4-(オクチルオキシ)ベンゾイルオキシ]フェニル]-2,4,7-トリオキサビシクロ[4.4.0]デカン
  • 4-[(2R,4aR,8aS)-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-2-イル]フェニル 4-(オクチルオキシ)ベンゾアート
  • 4-[(2R,4aR,8aS)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-2-yl]phenyl 4-(octyloxy)benzoate
Other name (1)：
  • (1S,3R,6R)-3-[4-[4-(Octyloxy)benzoyloxy]phenyl]-2,4,7-trioxabicyclo[4.4.0]decane
Thsaurus map：
Thesaurus Map

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