Chem
J-GLOBAL ID：200907063906226210   Nikkaji number：J2.349.158C

25,26,27,28-Tetrakis(dodecyloxy)pentacyclo[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-5,11,17,23-tetracarboxylic acid

25,26,27,28-テトラキス(ドデシルオキシ)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-5,11,17,23-テトラカルボン酸
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： C80H120O12
Molecular formula furigana： C80-H120-O12
Molecular weight： 1273.828
InChI： InChI=1S/C80H120O12/c1-5-9-13-17-21-25-29-33-37-41-45-89-73-61-49-63-55-70(78(83)84)57-65(74(63)90-46-42-38-34-30-26-22-18-14-10-6-2)51-67-59-72(80(87)88)60-68(76(67)92-48-44-40-36-32-28-24-20-16-12-8-4)52-66-58-71(79(85)86)56-64(50-62(73)54-69(53-61)77(81)82)75(66)91-47-43-39-35-31-27-23-19-15-11-7-3/h53-60H,5-52H2,1-4H3,(H,81,82)(H,83,84)(H,85,86)(H,87,88)
InChI key： RHFXMWNOIMLKCU-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc1cc(c2)C(=O)O)c5OCCCCCCCCCCCC)C(=O)O)c4OCCCCCCCCCCCC)C(=O)O)c3OCCCCCCCCCCCC)C(=O)O
Systematic name  (2)：
  • 25,26,27,28-テトラキス(ドデシルオキシ)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-5,11,17,23-テトラカルボン酸
  • 25,26,27,28-tetrakis(dodecyloxy)pentacyclo[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-5,11,17,23-tetracarboxylic acid
Other name (1)：
  • 25,26,27,28-Tetrakis(dodecyloxy)pentacyclo[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-5,11,17,23-tetracarboxylic acid
Thsaurus map：
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