Chem
J-GLOBAL ID：200907033132462998   Nikkaji number：J18.209E

NSC-249918

ゴヤゼンソリド
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： C19H20O7
Molecular formula furigana： C19-H20-O7
Molecular weight： 360.362
InChI： InChI=1S/C19H20O7/c1-9(2)17(22)25-14-7-19(4)15(21)6-12(26-19)11(8-20)5-13-16(14)10(3)18(23)24-13/h5-6,13-14,16,20H,1,3,7-8H2,2,4H3/b11-5-/t13-,14+,16+,19-/m1/s1
InChI key： HTMCLLSRQWRPTN-OKMRAYSCSA-N
SMILES： CC(=C)C(=O)O[C@H]1C[C@@]2(C)OC(=CC2=O)/C(=C\[C@H]2OC(=O)C(=C)[C@H]12)/CO
Systematic name  (3)：
  • 2-メチルプロペン酸[(3aR,4S,6R,10Z,11aR)-2,3,3a,4,5,6,7,11a-オクタヒドロ-10-ヒドロキシメチル-6-メチル-3-メチレン-2,7-ジオキソ-6,9-エポキシシクロデカ[b]フラン-4-イル]
  • (2Z,4R,8R,9S,11R)-2-(ヒドロキシメチル)-11-メチル-7-メチリデン-6,12-ジオキソ-5,14-ジオキサトリシクロ[9.2.1.04,8]テトラデカ-1(13),2-ジエン-9-イル 2-メチルプロパ-2-エノアート
  • (2Z,4R,8R,9S,11R)-2-(hydroxymethyl)-11-methyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-1(13),2-dien-9-yl 2-methylprop-2-enoate
Other name (4)：
  • ゴヤゼンソリド
  • Goyazensolide
  • 2-Methylpropenoic acid [(3aR,4S,6R,10Z,11aR)-2,3,3a,4,5,6,7,11a-octahydro-10-hydroxymethyl-6-methyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca[b]furan-4-yl] ester
  • NSC-249918
CAS registry number： 60066-35-5
KEGG COMPOUND： C09467
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