Chem
J-GLOBAL ID：200907042692689733   Nikkaji number：J2.201.493E

Trichurusin B

トリクルシンB
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： C25H40O6
Molecular formula furigana： C25-H40-O6
Molecular weight： 436.589
InChI： InChI=1S/C25H40O6/c1-6-17(2)13-19(4)14-20(5)25-22(8-10-24(29)31-25)30-23(28)9-7-18(3)15-21(16-27)11-12-26/h6-7,9,15,19-22,25-27H,8,10-14,16H2,1-5H3/b9-7+,17-6+,18-15+
InChI key： OCXVGVTWMGMEPW-DVYBMHRESA-N
SMILES： C/C=C(\C)/CC(C)CC(C)C1OC(=O)CCC1OC(=O)/C=C/C(=C/C(CO)CCO)/C
Systematic name  (3)：
  • (2E,4E)-4-メチル-6-(ヒドロキシメチル)-8-ヒドロキシ-2,4-オクタジエン酸2-[(5E)-1,3,5-トリメチル-5-ヘプテニル]-6-オキソテトラヒドロ-2H-ピラン-3-イル
  • 2-[(6E)-4,6-ジメチルオクタ-6-エン-2-イル]-6-オキソオキサン-3-イル (2E,4E)-8-ヒドロキシ-6-(ヒドロキシメチル)-4-メチルオクタ-2,4-ジエノアート
  • 2-[(6E)-4,6-dimethyloct-6-en-2-yl]-6-oxooxan-3-yl (2E,4E)-8-hydroxy-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
Other name (3)：
  • (2E,4E)-4-Methyl-6-(hydroxymethyl)-8-hydroxy-2,4-octadienoic acid 2-[(5E)-1,3,5-trimethyl-5-heptenyl]-6-oxotetrahydro-2H-pyran-3-yl ester
  • トリクルシンB
  • Trichurusin B
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