Chem
J-GLOBAL ID：200907048535625967   Nikkaji number：J93.414C

Altertoxin I

アルテルトキシンI
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： C20H16O6
Molecular formula furigana： C20-H16-O6
Molecular weight： 352.342
InChI： InChI=1S/C20H16O6/c21-10-3-1-8-9-2-4-11(22)17-12(23)5-6-20(26,18(9)17)19-14(25)7-13(24)16(10)15(8)19/h1-4,14,19,21-22,25-26H,5-7H2/t14-,19+,20-/m0/s1
InChI key： GJIALGLHOBXNAT-KPOBHBOGSA-N
SMILES： O[C@H]1CC(=O)c2c(O)ccc3c4ccc(O)c5C(=O)CC[C@@](O)([C@H]1c23)c45
Systematic name  (3)：
  • (1S)-1,2,11,12,12a,12bβ-ヘキサヒドロ-1β,4,9,12aα-テトラヒドロキシ-3,10-ペリレンジオン
  • (1S,12aR,12bS)-1,4,9,12a-テトラヒドロキシ-1,2,3,10,11,12,12a,12b-オクタヒドロペリレン-3,10-ジオン
  • (1S,12aR,12bS)-1,4,9,12a-tetrahydroxy-1,2,3,10,11,12,12a,12b-octahydroperylene-3,10-dione
Other name (6)：
  • アルテルトキシンI
  • ジヒドロアルテルペリレノール
  • Dihydroalterperylenol
  • ATX-1
  • Altertoxin I
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CAS registry number： 56258-32-3
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