Chem
J-GLOBAL ID：200907072058583651   Nikkaji number：J1.930.798K

SM-216289

SM-216289
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： C28H18O14
Molecular formula furigana： C28-H18-O14
Molecular weight： 578.438
InChI： InChI=1S/C28H18O14/c1-7-9(21(32)11-6-41-14-4-12(30)24(35)19(27(37)38)17(14)23(11)34)3-10-22(33)18-15(42-26(10)16(7)8(2)29)5-13(31)25(36)20(18)28(39)40/h3-5,30-32,35-36H,6H2,1-2H3,(H,37,38)(H,39,40)
InChI key： VZJACTNXARYXEM-UHFFFAOYSA-N
SMILES： CC(=O)c1c(C)c(cc2c1oc1cc(O)c(O)c(C(=O)O)c1c2=O)C(=C1COc2cc(O)c(O)c(C(=O)O)c2C1=O)O
Systematic name  (3)：
  • 5-アセチル-7-[(5-カルボキシ-6,7-ジヒドロキシ-4-オキソ-2H-1-ベンゾピラン-3(4H)-イリデン)ヒドロキシメチル]-2,3-ジヒドロキシ-6-メチル-9-オキソ-9H-キサンテン-1-カルボン酸
  • 5-アセチル-7-[(5-カルボキシ-6,7-ジヒドロキシ-4-オキソ-3,4-ジヒドロ-2H-1-ベンゾピラン-3-イリデン)(ヒドロキシ)メチル]-2,3-ジヒドロキシ-6-メチル-9-オキソ-9H-キサンテン-1-カルボン酸
  • 5-acetyl-7-[(5-carboxy-6,7-dihydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3-ylidene)(hydroxy)methyl]-2,3-dihydroxy-6-methyl-9-oxo-9H-xanthene-1-carboxylic acid
Other name (4)：
  • 5-Acetyl-7-[(5-carboxy-6,7-dihydroxy-4-oxo-2H-1-benzopyran-3(4H)-ylidene)hydroxymethyl]-2,3-dihydroxy-6-methyl-9-oxo-9H-xanthene-1-carboxylic acid
  • キサントフルビン
  • Xanthofulvin
  • SM-216289
CAS registry number： 151466-15-8
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