Chem
J-GLOBAL ID：200907036709052270   Nikkaji number：J18.374A

Orizabin

オリザビン
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： C19H26O7
Molecular formula furigana： C19-H26-O7
Molecular weight： 366.410
InChI： InChI=1S/C19H26O7/c1-9(2)16(21)25-13-7-18(5)14(20)8-19(23,26-18)10(3)6-12-15(13)11(4)17(22)24-12/h6,9,12-15,20,23H,4,7-8H2,1-3,5H3/t12-,13-,14+,15+,18-,19-/m1/s1
InChI key： RHVYFOFKEZHFKR-LVPBSXMGSA-N
SMILES： CC(C)C(=O)O[C@@H]1C[C@@]2(C)O[C@](O)(C[C@@H]2O)C(=C[C@H]2OC(=O)C(=C)[C@H]12)C
Systematic name  (3)：
  • 2-メチルプロピオン酸[(3aR,4R,6R,7S,9R,11aR)-2,3,3a,4,5,6,7,8,9,11a-デカヒドロ-7,9-ジヒドロキシ-6,10-ジメチル-3-メチレン-2-オキソ-6,9-エポキシシクロデカ[b]フラン-4-イル]
  • (1R,4R,8R,9R,11R,12S)-1,12-ジヒドロキシ-2,11-ジメチル-7-メチリデン-6-オキソ-5,14-ジオキサトリシクロ[9.2.1.04,8]テトラデカ-2-エン-9-イル 2-メチルプロパノアート
  • (1R,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-2-en-9-yl 2-methylpropanoate
Other name (3)：
  • オリザビン
  • Orizabin
  • 2-Methylpropionic acid [(3aR,4R,6R,7S,9R,11aR)-2,3,3a,4,5,6,7,8,9,11a-decahydro-7,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo-6,9-epoxycyclodeca[b]furan-4-yl] ester
CAS registry number： 34367-14-1
KEGG COMPOUND： C09521
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