Chem
J-GLOBAL ID：200907051274839361   Nikkaji number：J748.009A

(11S,12S)-2,6-Bis(decyloxy)-9,10-dihydro-9β,10β-ethanoanthracene-11,12-dicarboxylic acid

(11S,12S)-2,6-ビス(デシルオキシ)-9,10-ジヒドロ-9β,10β-エタノアントラセン-11,12-ジカルボン酸
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： C38H54O6
Molecular formula furigana： C38-H54-O6
Molecular weight： 606.844
InChI： InChI=1S/C38H54O6/c1-3-5-7-9-11-13-15-17-23-43-27-19-21-29-31(25-27)33-30-22-20-28(44-24-18-16-14-12-10-8-6-4-2)26-32(30)34(29)36(38(41)42)35(33)37(39)40/h19-22,25-26,33-36H,3-18,23-24H2,1-2H3,(H,39,40)(H,41,42)/t33-,34-,35+,36+/m1/s1
InChI key： KSELFSSRVBWITF-NWJWHWDBSA-N
SMILES： CCCCCCCCCCOc1ccc2[C@H]3[C@@H]([C@H]([C@H](c4ccc(OCCCCCCCCCC)cc34)c2c1)C(=O)O)C(=O)O
Systematic name  (3)：
  • (11S,12S)-2,6-ビス(デシルオキシ)-9,10-ジヒドロ-9β,10β-エタノアントラセン-11,12-ジカルボン酸
  • (1R,8R,15S,16S)-4,11-ビス(デシルオキシ)テトラシクロ[6.6.2.02,7.09,14]ヘキサデカ-2,4,6,9,11,13-ヘキサエン-15,16-ジカルボン酸
  • (1R,8R,15S,16S)-4,11-bis(decyloxy)tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,16-dicarboxylic acid
Other name (1)：
  • (11S,12S)-2,6-Bis(decyloxy)-9,10-dihydro-9β,10β-ethanoanthracene-11,12-dicarboxylic acid
Thsaurus map：
Thesaurus Map

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