Chem
J-GLOBAL ID:200907053982934490   Nikkaji number:J850.965D

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

(1S,3R,6R)-3-[4-[4-(ヘキシルオキシ)フェノキシカルボニル]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: C26H32O6
Molecular formula furigana: C26-H32-O6
Molecular weight: 440.536
InChI: InChI=1S/C26H32O6/c1-2-3-4-5-16-28-21-12-14-22(15-13-21)31-25(27)19-8-10-20(11-9-19)26-30-18-24-23(32-26)7-6-17-29-24/h8-15,23-24,26H,2-7,16-18H2,1H3/t23-,24+,26+/m0/s1
InChI key: RIIJJWRBHDFYSB-BFLUCZKCSA-N
SMILES: CCCCCCOc1ccc(OC(=O)c2ccc(cc2)[C@@H]2OC[C@H]3OCCC[C@@H]3O2)cc1
Systematic name  (3):
  • (1S,3R,6R)-3-[4-[4-(ヘキシルオキシ)フェノキシカルボニル]フェニル]-2,4,7-トリオキサビシクロ[4.4.0]デカン
  • 4-(ヘキシルオキシ)フェニル 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]ベンゾアート
  • 4-(hexyloxy)phenyl 4-[(2R,4aR,8aS)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-2-yl]benzoate
Other name (1):
  • (1S,3R,6R)-3-[4-[4-(Hexyloxy)phenoxycarbonyl]phenyl]-2,4,7-trioxabicyclo[4.4.0]decane
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