Chem
J-GLOBAL ID:200907018122291517   Nikkaji number:J1.537.537J

5,11,17,23-Tetra-tert-butyl-25,26-bis(diisobutylcarbamoylmethoxy)-27,28-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-dodecene

5,11,17,23-テトラ-tert-ブチル-25,26-ビス(ジイソブチルカルバモイルメトキシ)-27,28-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: C64H94N2O6
Molecular formula furigana: C64-H94-N2-O6
Molecular weight: 987.464
InChI: InChI=1S/C64H94N2O6/c1-39(2)33-65(34-40(3)4)55(67)37-71-59-47-22-45-27-51(61(9,10)11)25-43(57(45)69)21-44-26-52(62(12,13)14)28-46(58(44)70)23-48-30-54(64(18,19)20)32-50(24-49(59)31-53(29-47)63(15,16)17)60(48)72-38-56(68)66(35-41(5)6)36-42(7)8/h25-32,39-42,69-70H,21-24,33-38H2,1-20H3
InChI key: BPNZLUKWJODIRF-UHFFFAOYSA-N
SMILES: CC(C)CN(CC(C)C)C(=O)COc1c2Cc3cc(cc(Cc4cc(cc(Cc5cc(cc(Cc1cc(c2)C(C)(C)C)c5OCC(=O)N(CC(C)C)CC(C)C)C(C)(C)C)c4O)C(C)(C)C)c3O)C(C)(C)C
Systematic name  (3):
  • 5,11,17,23-テトラ-tert-ブチル-25,26-ビス(ジイソブチルカルバモイルメトキシ)-27,28-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
  • 2-[(26-{[ビス(2-メチルプロピル)カルバモイル]メトキシ}-5,11,17,23-テトラ-tert-ブチル-27,28-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]-N,N-ビス(2-メチルプロピル)アセトアミド
  • 2-[(26-{[bis(2-methylpropyl)carbamoyl]methoxy}-5,11,17,23-tetra-tert-butyl-27,28-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-dodecaen-25-yl)oxy]-N,N-bis(2-methylpropyl)acetamide
Other name (1):
  • 5,11,17,23-Tetra-tert-butyl-25,26-bis(diisobutylcarbamoylmethoxy)-27,28-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-dodecene
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