Chem
J-GLOBAL ID：201507049855952668
Nikkaji number：J3.370.795I
5-[2-[5-[α-[5-[3-[5-[α-[5-[2-(5-Formyl-1H-pyrrole-2-yl)propane-2-yl]-2H-pyrrole-2-ylidene]benzyl]-3,4-diethyl-1H-pyrrole-2-yl]phenyl]-3,4-diethyl-2H-pyrrole-2-ylidene]benzyl]-1H-pyrrole-2-yl]propane-2-yl]-1H-pyrrole-2-carbaldehyde
5-[2-[5-[α-[5-[3-[5-[α-[5-[2-(5-ホルミル-1H-ピロール-2-イル)プロパン-2-イル]-2H-ピロール-2-イリデン]ベンジル]-3,4-ジエチル-1H-ピロール-2-イル]フェニル]-3,4-ジエチル-2H-ピロール-2-イリデン]ベンジル]-1H-ピロール-2-イル]プロパン-2-イル]-1H-ピロール-2-カルボアルデヒド
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： C60H60N6O2
Molecular formula furigana： C60-H60-N6-O2
Molecular weight： 897.180
InChI：
InChI=1S/C60H60N6O2/c1-9-43-45(11-3)57(53(37-20-15-13-16-21-37)47-28-32-51(63-47)59(5,6)49-30-26-41(35-67)61-49)65-55(43)39-24-19-25-40(34-39)56-44(10-2)46(12-4)58(66-56)54(38-22-17-14-18-23-38)48-29-33-52(64-48)60(7,8)50-31-27-42(36-68)62-50/h13-36,61-63,66H,9-12H2,1-8H3
InChI key：
NSTSZVFNMRIVKF-UHFFFAOYSA-N
SMILES：
CCC1=C(CC)C(=NC1=C(c1ccc([nH]1)C(C)(C)c1ccc(C=O)[nH]1)c1ccccc1)c1cccc(c1)c1[nH]c(C(=C2C=CC(=N2)C(C)(C)c2ccc(C=O)[nH]2)c2ccccc2)c(CC)c1CC
Systematic name (3)：
- 5-[2-[5-[α-[5-[3-[5-[α-[5-[2-(5-ホルミル-1H-ピロール-2-イル)プロパン-2-イル]-2H-ピロール-2-イリデン]ベンジル]-3,4-ジエチル-1H-ピロール-2-イル]フェニル]-3,4-ジエチル-2H-ピロール-2-イリデン]ベンジル]-1H-ピロール-2-イル]プロパン-2-イル]-1H-ピロール-2-カルボアルデヒド
- 5-(2-{5-[(5-{3-[3,4-ジエチル-5-({5-[2-(5-ホルミル-1H-ピロール-2-イル)プロパン-2-イル]-2H-ピロール-2-イリデン}(フェニル)メチル)-1H-ピロール-2-イル]フェニル}-3,4-ジエチル-2H-ピロール-2-イリデン)(フェニル)メチル]-1H-ピロール-2-イル}プロパン-2-イル)-1H-ピロール-2-カルバルデヒド
- 5-(2-{5-[(5-{3-[3,4-diethyl-5-({5-[2-(5-formyl-1H-pyrrol-2-yl)propan-2-yl]-2H-pyrrol-2-ylidene}(phenyl)methyl)-1H-pyrrol-2-yl]phenyl}-3,4-diethyl-2H-pyrrol-2-ylidene)(phenyl)methyl]-1H-pyrrol-2-yl}propan-2-yl)-1H-pyrrole-2-carbaldehyde
- 5-[2-[5-[α-[5-[3-[5-[α-[5-[2-(5-Formyl-1H-pyrrole-2-yl)propane-2-yl]-2H-pyrrole-2-ylidene]benzyl]-3,4-diethyl-1H-pyrrole-2-yl]phenyl]-3,4-diethyl-2H-pyrrole-2-ylidene]benzyl]-1H-pyrrole-2-yl]propane-2-yl]-1H-pyrrole-2-carbaldehyde
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