Chem
J-GLOBAL ID:200907040774466055
Nikkaji number:J847.085E
4,5-[2,7-Di-tert-butyl-9,9-dimethyl-9H-xanthene-4,5-diylbis(methyleneoxycarbonyl)]2,7-di-tert-butyl-9,9-dimethyl-9H-xanthene
4,5-[2,7-ジ-tert-ブチル-9,9-ジメチル-9H-キサンテン-4,5-ジイルビス(メチレンオキシカルボニル)]2,7-ジ-tert-ブチル-9,9-ジメチル-9H-キサンテン
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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:
C50 H60 O6
Molecular formula furigana:
C50-H60-O6
Molecular weight:
757.024
InChI:
InChI=1S/C50H60O6/c1-45(2,3)29-17-27-25-53-43(51)33-19-31(47(7,8)9)23-37-41(33)56-42-34(20-32(48(10,11)12)24-38(42)50(37,15)16)44(52)54-26-28-18-30(46(4,5)6)22-36-40(28)55-39(27)35(21-29)49(36,13)14/h17-24H,25-26H2,1-16H3
InChI key:
AEODWWCJYPUWCX-UHFFFAOYSA-N
SMILES:
CC(C)(C)c1cc2COC(=O)c3cc(cc4c3Oc3c(cc(cc3C4(C)C)C(C)(C)C)C(=O)OCc3cc(cc4c3Oc2c(c1)C4(C)C)C(C)(C)C)C(C)(C)C
Systematic name (3):
4,5-[2,7-ジ-tert-ブチル-9,9-ジメチル-9H-キサンテン-4,5-ジイルビス(メチレンオキシカルボニル)]2,7-ジ-tert-ブチル-9,9-ジメチル-9H-キサンテン
3,11,19,27-テトラ-tert-ブチル-33,33,34,34-テトラメチル-7,15,23,31-テトラオキサヘプタシクロ[27.3.1.113,17 .05,32 .09,14 .016,21 .025,30 ]テトラトリアコンタ-1,3,5(32),9,11,13,16(21),17,19,25,27,29-ドデカエン-6,24-ジオン
3,11,19,27-tetra-tert-butyl-33,33,34,34-tetramethyl-7,15,23,31-tetraoxaheptacyclo[27.3.1.113,17 .05,32 .09,14 .016,21 .025,30 ]tetratriaconta-1,3,5(32),9,11,13,16(21),17,19,25,27,29-dodecaene-6,24-dione
Other name (1):
4,5-[2,7-Di-tert-butyl-9,9-dimethyl-9H-xanthene-4,5-diylbis(methyleneoxycarbonyl)]2,7-di-tert-butyl-9,9-dimethyl-9H-xanthene
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