Chem
J-GLOBAL ID：200907043080083697   Nikkaji number：J2.767.792D

Drummondin A

ドルモンジンA
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： C26H30O8
Molecular formula furigana： C26-H30-O8
Molecular weight： 470.518
InChI： InChI=1S/C26H30O8/c1-7-15(27)17-20(30)13(19(29)12-9-10-25(3,4)34-22(12)17)11-14-21(31)18(16(28)8-2)24(33)26(5,6)23(14)32/h9-10,29-30,32-33H,7-8,11H2,1-6H3
InChI key： KFOIHZFXWKXAHE-UHFFFAOYSA-N
SMILES： CCC(=O)C1=C(O)C(C)(C)C(=C(Cc2c(O)c3C=CC(C)(C)Oc3c(C(=O)CC)c2O)C1=O)O
Systematic name  (3)：
  • 2-[(5,7-ジヒドロキシ-2,2-ジメチル-8-プロパノイル-2H-1-ベンゾピラン-6-イル)メチル]-3,5-ジヒドロキシ-4,4-ジメチル-6-プロパノイル-2,5-シクロヘキサジエン-1-オン
  • 2-[(5,7-ジヒドロキシ-2,2-ジメチル-8-プロパノイル-2H-クロメン-6-イル)メチル]-3,5-ジヒドロキシ-4,4-ジメチル-6-プロパノイルシクロヘキサ-2,5-ジエン-1-オン
  • 2-[(5,7-dihydroxy-2,2-dimethyl-8-propanoyl-2H-chromen-6-yl)methyl]-3,5-dihydroxy-4,4-dimethyl-6-propanoylcyclohexa-2,5-dien-1-one
Other name (3)：
  • 2-[(5,7-Dihydroxy-2,2-dimethyl-8-propanoyl-2H-1-benzopyran-6-yl)methyl]-3,5-dihydroxy-4,4-dimethyl-6-propanoyl-2,5-cyclohexadiene-1-one
  • Drummondin A
  • ドルモンジンA
CAS registry number： 119171-76-5
KEGG COMPOUND： C09004
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