Chem
J-GLOBAL ID:200907093545660090
Nikkaji number:J1.050.933E
Heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-37,38,39,40,41,42-hexylhexakis(oxyethylene)hexakis(diphenylphosphine oxide)
37,38,39,40,41,42-ヘキサキス[2-(ジフェニルホスホロソ)エトキシ]ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン
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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:
C126 H114 O12 P6
Molecular formula furigana:
C126-H114-O12-P6
Molecular weight:
2006.129
InChI:
InChI=1S/C126H114O12P6/c127-139(109-55-13-1-14-56-109,110-57-15-2-16-58-110)85-79-133-121-97-43-37-44-98(121)92-100-46-39-48-102(123(100)135-81-87-141(129,113-63-21-5-22-64-113)114-65-23-6-24-66-114)94-104-50-41-52-106(125(104)137-83-89-143(131,117-71-29-9-30-72-117)118-73-31-10-32-74-118)96-108-54-42-53-107(126(108)138-84-90-144(132,119-75-33-11-34-76-119)120-77-35-12-36-78-120)95-105-51-40-49-103(124(105)136-82-88-142(130,115-67-25-7-26-68-115)116-69-27-8-28-70-116)93-101-47-38-45-99(91-97)122(101)134-80-86-140(128,111-59-17-3-18-60-111)112-61-19-4-20-62-112/h1-78H,79-96H2
InChI key:
KJCIVXISTAPYPA-UHFFFAOYSA-N
SMILES:
O=P(CCOc1c2Cc3cccc(Cc4cccc(Cc5cccc(Cc6cccc(Cc7cccc(Cc1ccc2)c7OCCP(=O)(c1ccccc1)c1ccccc1)c6OCCP(=O)(c1ccccc1)c1ccccc1)c5OCCP(=O)(c1ccccc1)c1ccccc1)c4OCCP(=O)(c1ccccc1)c1ccccc1)c3OCCP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
Systematic name (3):
ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン-37,38,39,40,41,42-ヘキサイルヘキサキス(オキシエチレン)ヘキサキス(ジフェニルホスフィンオキシド)
37,38,39,40,41,42-ヘキサキス[2-(ジフェニルホスホロソ)エトキシ]ヘプタシクロ[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]ドテトラコンタ-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-オクタデカエン
37,38,39,40,41,42-hexakis[2-(diphenylphosphoroso)ethoxy]heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaene
Other name (1):
Heptacyclo[31.3.1.13,7 .19,13 .115,19 .121,25 .127,31 ]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecene-37,38,39,40,41,42-hexylhexakis(oxyethylene)hexakis(diphenylphosphine oxide)
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