Chem
J-GLOBAL ID:200907017364704372   Nikkaji number:J1.757.594E

Bisoctadecanoic acid [1,7-heptanediylbisoxybis(7-oxo-1,3,5-cycloheptatriene-4,1-diyl)] ester

ビスオクタデカン酸[1,7-ヘプタンジイルビスオキシビス(7-オキソ-1,3,5-シクロヘプタトリエン-4,1-ジイル)]
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: C57H92O8
Molecular formula furigana: C57-H92-O8
Molecular weight: 905.355
InChI: InChI=1S/C57H92O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-34-38-56(60)64-54-46-42-50(40-44-52(54)58)62-48-36-32-29-33-37-49-63-51-41-45-53(59)55(47-43-51)65-57(61)39-35-31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h40-47H,3-39,48-49H2,1-2H3
InChI key: NDEMQKJIXODRTG-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCCC(=O)Oc1ccc(OCCCCCCCOc2ccc(OC(=O)CCCCCCCCCCCCCCCCC)c(=O)cc2)ccc1=O
Systematic name  (3):
  • ビスオクタデカン酸[1,7-ヘプタンジイルビスオキシビス(7-オキソ-1,3,5-シクロヘプタトリエン-4,1-ジイル)]
  • 4-[(7-{[4-(オクタデカノイルオキシ)-5-オキソシクロヘプタ-1,3,6-トリエン-1-イル]オキシ}ヘプチル)オキシ]-7-オキソシクロヘプタ-1,3,5-トリエン-1-イル オクタデカノアート
  • 4-[(7-{[4-(octadecanoyloxy)-5-oxocyclohepta-1,3,6-trien-1-yl]oxy}heptyl)oxy]-7-oxocyclohepta-1,3,5-trien-1-yl octadecanoate
Other name (1):
  • Bisoctadecanoic acid [1,7-heptanediylbisoxybis(7-oxo-1,3,5-cycloheptatriene-4,1-diyl)] ester
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