Chem
J-GLOBAL ID:201907020810904990
Nikkaji number:J3.731.515J
16,25-ジオキサヘプタシクロ[24.12.0.02,15 .03,12 .05,10 .029,38 .031,36 ]オクタトリアコンタ-1(26),2(15),3,5(10),6,8,11,13,27,29,31(36),32,34,37-テトラデカエン
16,25-ジオキサヘプタシクロ[24.12.0.02,15 .03,12 .05,10 .029,38 .031,36 ]オクタトリアコンタ-1(26),2(15),3,5(10),6,8,11,13,27,29,31(36),32,34,37-テトラデカエン
Download MOL file
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:
C36 H32 O2
Molecular formula furigana:
C36-H32-O2
Molecular weight:
496.650
InChI:
InChI=1S/C36H32O2/c1-2-4-10-20-38-34-18-16-30-22-26-12-6-8-14-28(26)24-32(30)36(34)35-31-23-27-13-7-5-11-25(27)21-29(31)15-17-33(35)37-19-9-3-1/h5-8,11-18,21-24H,1-4,9-10,19-20H2
InChI key:
NRSYSFCFJXCHKU-UHFFFAOYSA-N
SMILES:
c1cccc2c1cc1c(c2)c2c(cc1)OCCCCCCCCOc1ccc3cc4ccccc4cc3c21
Systematic name (2):
16,25-ジオキサヘプタシクロ[24.12.0.02,15 .03,12 .05,10 .029,38 .031,36 ]オクタトリアコンタ-1(26),2(15),3,5(10),6,8,11,13,27,29,31(36),32,34,37-テトラデカエン
16,25-dioxaheptacyclo[24.12.0.02,15 .03,12 .05,10 .029,38 .031,36 ]octatriaconta-1(26),2(15),3,5(10),6,8,11,13,27,29,31(36),32,34,37-tetradecaene
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