Chem
J-GLOBAL ID：200907048728314608   Nikkaji number：J13.914I

Pteryxin

プテリキシン
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： C21H22O7
Molecular formula furigana： C21-H22-O7
Molecular weight： 386.400
InChI： InChI=1S/C21H22O7/c1-6-11(2)20(24)27-18-16-14(28-21(4,5)19(18)25-12(3)22)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3/b11-6-/t18-,19-/m1/s1
InChI key： LYUZYPKZQDYMEE-YRCPKEQFSA-N
SMILES： C/C=C(/C)\C(=O)O[C@H]1[C@@H](OC(=O)C)C(C)(C)Oc2ccc3ccc(=O)oc3c12
Systematic name  (3)：
  • (Z)-2-メチル-2-ブテン酸[(9R)-9-アセトキシ-9,10-ジヒドロ-8,8-ジメチル-2-オキソ-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン-10α-イル]
  • (9R,10R)-9-(アセチルオキシ)-8,8-ジメチル-2-オキソ-2H,8H,9H,10H-ピラノ[2,3-h]クロメン-10-イル (2Z)-2-メチルブタ-2-エノアート
  • (9R,10R)-9-(acetyloxy)-8,8-dimethyl-2-oxo-2H,8H,9H,10H-pyrano[2,3-h]chromen-10-yl (2Z)-2-methylbut-2-enoate
Other name (3)：
  • プテリキシン
  • Pteryxin
  • (Z)-2-Methyl-2-butenoic acid [(9R)-9-acetoxy-9,10-dihydro-8,8-dimethyl-2-oxo-2H,8H-benzo[1,2-b:3,4-b′]dipyran-10α-yl] ester
CAS registry number： 13161-75-6
KEGG COMPOUND： C09307
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