Chem
J-GLOBAL ID：201107096363557223
Nikkaji number：J2.924.622J
Benzene-1,3,5-tricarboxylic acid 1,3-bis(3-furylmethyl)5-[4-[α,α-dimethyl-4-[1,1-bis[4-[3,5-bis(3-furylmethoxycarbonyl)benzoyloxy]phenyl]ethyl]benzyl]phenyl] ester
ベンゼン-1,3,5-トリカルボン酸1,3-ビス(3-フリルメチル)5-[4-[α,α-ジメチル-4-[1,1-ビス[4-[3,5-ビス(3-フリルメトキシカルボニル)ベンゾイルオキシ]フェニル]エチル]ベンジル]フェニル]
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： C86H64O24
Molecular formula furigana： C86-H64-O24
Molecular weight： 1481.434
InChI：
InChI=1S/C86H64O24/c1-85(2,69-8-14-73(15-9-69)108-82(93)65-35-59(76(87)102-47-53-20-26-96-41-53)32-60(36-65)77(88)103-48-54-21-27-97-42-54)68-4-6-70(7-5-68)86(3,71-10-16-74(17-11-71)109-83(94)66-37-61(78(89)104-49-55-22-28-98-43-55)33-62(38-66)79(90)105-50-56-23-29-99-44-56)72-12-18-75(19-13-72)110-84(95)67-39-63(80(91)106-51-57-24-30-100-45-57)34-64(40-67)81(92)107-52-58-25-31-101-46-58/h4-46H,47-52H2,1-3H3
InChI key：
YONFXIIOFGNBMG-UHFFFAOYSA-N
SMILES：
CC(C)(c1ccc(OC(=O)c2cc(cc(c2)C(=O)OCc2ccoc2)C(=O)OCc2ccoc2)cc1)c1ccc(cc1)C(C)(c1ccc(OC(=O)c2cc(cc(c2)C(=O)OCc2ccoc2)C(=O)OCc2ccoc2)cc1)c1ccc(OC(=O)c2cc(cc(c2)C(=O)OCc2ccoc2)C(=O)OCc2ccoc2)cc1
Systematic name (3)：
- ベンゼン-1,3,5-トリカルボン酸1,3-ビス(3-フリルメチル)5-[4-[α,α-ジメチル-4-[1,1-ビス[4-[3,5-ビス(3-フリルメトキシカルボニル)ベンゾイルオキシ]フェニル]エチル]ベンジル]フェニル]
- 1-[4-(2-{4-[1,1-ビス({4-[3,5-ビス({[(フラン-3-イル)メトキシ]カルボニル})ベンゾイルオキシ]フェニル})エチル]フェニル}プロパン-2-イル)フェニル] 3,5-ビス[(フラン-3-イル)メチル] ベンゼン-1,3,5-トリカルボキシラート
- 1-[4-(2-{4-[1,1-bis({4-[3,5-bis({[(furan-3-yl)methoxy]carbonyl})benzoyloxy]phenyl})ethyl]phenyl}propan-2-yl)phenyl] 3,5-bis[(furan-3-yl)methyl] benzene-1,3,5-tricarboxylate
- Benzene-1,3,5-tricarboxylic acid 1,3-bis(3-furylmethyl)5-[4-[α,α-dimethyl-4-[1,1-bis[4-[3,5-bis(3-furylmethoxycarbonyl)benzoyloxy]phenyl]ethyl]benzyl]phenyl] ester
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