Chem
J-GLOBAL ID:200907058082297071   Nikkaji number:J2.268.332B

25,27-Bis(butoxycarbonylmethoxy)-26,28-dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene

25,27-ビス(ブトキシカルボニルメトキシ)-26,28-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン
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: C40H44O8
Molecular formula furigana: C40-H44-O8
Molecular weight: 652.784
InChI: InChI=1S/C40H44O8/c1-3-5-19-45-35(41)25-47-39-31-15-9-16-32(39)22-28-12-8-14-30(38(28)44)24-34-18-10-17-33(23-29-13-7-11-27(21-31)37(29)43)40(34)48-26-36(42)46-20-6-4-2/h7-18,43-44H,3-6,19-26H2,1-2H3
InChI key: FWTJDFDOMDFKHW-UHFFFAOYSA-N
SMILES: CCCCOC(=O)COc1c2Cc3cccc(Cc4cccc(Cc5cccc(Cc1ccc2)c5O)c4OCC(=O)OCCCC)c3O
Systematic name  (6):
  • [25,27-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-26,28-ジイルビスオキシ]二酢酸ジブチル
  • 2,2′-[25,27-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-26,28-ジイルビスオキシ]ビス(酢酸ブチル)
  • [[26,28-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25,27-ジイル]ビスオキシ]二(酢酸ブチル)
  • 25,27-ビス(ブトキシカルボニルメトキシ)-26,28-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン
  • ブチル 2-{[27-(2-ブトキシ-2-オキソエトキシ)-26,28-ジヒドロキシペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-ドデカエン-25-イル]オキシ}アセタート
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Other name (4):
  • [25,27-Dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-26,28-diylbisoxy]diacetic acid dibutyl ester
  • 2,2′-[25,27-Dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-26,28-diylbisoxy]bis(acetic acid butyl) ester
  • [[26,28-Dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-25,27-diyl]bisoxy]di(acetic acid butyl) ester
  • 25,27-Bis(butoxycarbonylmethoxy)-26,28-dihydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene
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