Chem
J-GLOBAL ID：200907024010832981
Nikkaji number：J2.770.337B
2,8,14,20,26-Pentakis(1-acetyl-2-oxopropyl)-5,11,17,23,29-pentatert-butyl-31,32,33,34,35-pentamethoxyhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaene
2,8,14,20,26-ペンタキス(1-アセチル-2-オキソプロピル)-5,11,17,23,29-ペンタtert-ブチル-31,32,33,34,35-ペンタメトキシヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン
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
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
Molecular formula： C85H110O15
Molecular formula furigana： C85-H110-O15
Molecular weight： 1371.800
InChI：
InChI=1S/C85H110O15/c1-41(86)66(42(2)87)71-56-31-51(81(11,12)13)33-58(76(56)96-26)72(67(43(3)88)44(4)89)60-35-53(83(17,18)19)37-62(78(60)98-28)74(69(47(7)92)48(8)93)64-39-55(85(23,24)25)40-65(80(64)100-30)75(70(49(9)94)50(10)95)63-38-54(84(20,21)22)36-61(79(63)99-29)73(68(45(5)90)46(6)91)59-34-52(82(14,15)16)32-57(71)77(59)97-27/h31-40,66-75H,1-30H3
InChI key：
XYVMKJATPXPLAW-UHFFFAOYSA-N
SMILES：
COc1c2cc(cc1C(C(C(=O)C)C(=O)C)c1cc(cc(C(C(C(=O)C)C(=O)C)c3cc(cc(C(C(C(=O)C)C(=O)C)c4cc(cc(C(C(C(=O)C)C(=O)C)c5cc(cc(C2C(C(=O)C)C(=O)C)c5OC)C(C)(C)C)c4OC)C(C)(C)C)c3OC)C(C)(C)C)c1OC)C(C)(C)C)C(C)(C)C
Systematic name (3)：
- 2,8,14,20,26-ペンタキス(1-アセチル-2-オキソプロピル)-5,11,17,23,29-ペンタtert-ブチル-31,32,33,34,35-ペンタメトキシヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン
- 3-[5,11,17,23,29-ペンタ-tert-ブチル-8,14,20,26-テトラキス(2,4-ジオキソペンタン-3-イル)-31,32,33,34,35-ペンタメトキシヘキサシクロ[25.3.1.13,7.19,13.115,19.121,25]ペンタトリアコンタ-1(31),3(35),4,6,9,11,13(34),15,17,19(33),21,23,25(32),27,29-ペンタデカエン-2-イル]ペンタン-2,4-ジオン
- 3-[5,11,17,23,29-penta-tert-butyl-8,14,20,26-tetrakis(2,4-dioxopentan-3-yl)-31,32,33,34,35-pentamethoxyhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3(35),4,6,9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaen-2-yl]pentane-2,4-dione
- 2,8,14,20,26-Pentakis(1-acetyl-2-oxopropyl)-5,11,17,23,29-pentatert-butyl-31,32,33,34,35-pentamethoxyhexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaene
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