Chem
J-GLOBAL ID：200907089700914128   Nikkaji number：J2.470.430K

4,24-(Carboxymethylenedioxy)-6,10:12,16:18,22-tri(methylenedioxy)-5,11,17,23-tetramethyl-2,8,14,20-tetrapentylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene

4,24-(カルボキシメチレンジオキシ)-6,10:12,16:18,22-トリ(メチレンジオキシ)-5,11,17,23-テトラメチル-2,8,14,20-テトラペンチルペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-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： C57H72O10
Molecular formula furigana： C57-H72-O10
Molecular weight： 917.193
InChI： InChI=1S/C57H72O10/c1-9-13-17-21-36-40-25-42-37(22-18-14-10-2)44-27-46-39(24-20-16-12-4)47-28-45-38(23-19-15-11-3)43-26-41(36)49-33(6)51(43)63-31-65-53(45)35(8)55(47)67-57(56(58)59)66-54(46)34(7)52(44)64-30-62-50(42)32(5)48(40)60-29-61-49/h25-28,36-39,57H,9-24,29-31H2,1-8H3,(H,58,59)
InChI key： DPXSTNQVISWSAF-UHFFFAOYSA-N
SMILES： CCCCCC1c2cc3C(CCCCC)c4cc5C(CCCCC)c6cc7C(CCCCC)c8cc1c1OCOc2c(C)c3OCOc4c(C)c5OC(Oc6c(C)c7OCOc8c1C)C(=O)O
Systematic name  (3)：
  • 4,24-(カルボキシメチレンジオキシ)-6,10:12,16:18,22-トリ(メチレンジオキシ)-5,11,17,23-テトラメチル-2,8,14,20-テトラペンチルペンタシクロ[19.3.1.13,7.19,13.115,19]オクタコサ-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-ドデカエン
  • 6,12,18,39-テトラメチル-25,29,33,37-テトラペンチル-2,4,8,10,14,16,20,22-オクタオキサノナシクロ[21.15.1.124,38.05,36.07,34.011,32.013,30.017,28.019,26]テトラコンタ-1(39),5(36),6,11(32),12,17(28),18,23,26,30,34,38(40)-ドデカエン-3-カルボン酸
  • 6,12,18,39-tetramethyl-25,29,33,37-tetrapentyl-2,4,8,10,14,16,20,22-octaoxanonacyclo[21.15.1.124,38.05,36.07,34.011,32.013,30.017,28.019,26]tetraconta-1(39),5(36),6,11(32),12,17(28),18,23,26,30,34,38(40)-dodecaene-3-carboxylic acid
Other name (1)：
  • 4,24-(Carboxymethylenedioxy)-6,10:12,16:18,22-tri(methylenedioxy)-5,11,17,23-tetramethyl-2,8,14,20-tetrapentylpentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene
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