Chem
J-GLOBAL ID：200907079159774584   Nikkaji number：J2.770.070E

Multiradiatin

マルチラジアチン
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： C20H22O6
Molecular formula furigana： C20-H22-O6
Molecular weight： 358.390
InChI： InChI=1S/C20H22O6/c1-9(2)8-14(22)25-18-15-11(4)19(24)26-17(15)16(23)10(3)12-6-7-13(21)20(12,18)5/h6-8,10,12,15,17-18H,4H2,1-3,5H3/t10-,12-,15+,17-,18-,20-/m0/s1
InChI key： AUJNARNSAAQNAK-WWHLYTOASA-N
SMILES： C[C@H]1[C@@H]2C=CC(=O)[C@@]2(C)[C@@H](OC(=O)C=C(C)C)[C@H]2[C@H](OC(=O)C2=C)C1=O
Systematic name  (3)：
  • 3-メチル-2-ブテン酸(3aS)-2,3,3aα,4,4a,5,7aα,8,9,9aα-デカヒドロ-4aβ,8α-ジメチル-3-メチレン-2,5,9-トリオキソアズレノ[6,5-b]フラン-4α-イル
  • (3aS,4S,4aR,7aS,8S,9aS)-4a,8-ジメチル-3-メチリデン-2,5,9-トリオキソ-2H,3H,3aH,4H,4aH,5H,7aH,8H,9H,9aH-アズレノ[6,5-b]フラン-4-イル 3-メチルブタ-2-エノアート
  • (3aS,4S,4aR,7aS,8S,9aS)-4a,8-dimethyl-3-methylidene-2,5,9-trioxo-2H,3H,3aH,4H,4aH,5H,7aH,8H,9H,9aH-azuleno[6,5-b]furan-4-yl 3-methylbut-2-enoate
Other name (3)：
  • 3-Methyl-2-butenoic acid (3aS)-2,3,3aα,4,4a,5,7aα,8,9,9aα-decahydro-4aβ,8α-dimethyl-3-methylene-2,5,9-trioxoazuleno[6,5-b]furan-4α-yl ester
  • Multiradiatin
  • マルチラジアチン
CAS registry number： 58262-52-5
KEGG COMPOUND： C09515
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