Chem
J-GLOBAL ID：200907041445142075   Nikkaji number：J156.629F

Ustilaginoidin A

ウスチラギノイジン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： C28H18O10
Molecular formula furigana： C28-H18-O10
Molecular weight： 514.442
InChI： InChI=1S/C28H18O10/c1-9-3-13(29)25-19(37-9)5-11-21(15(31)7-17(33)23(11)27(25)35)22-12-6-20-26(14(30)4-10(2)38-20)28(36)24(12)18(34)8-16(22)32/h3-8,31-36H,1-2H3
InChI key： GCSBLYZTGOQVPI-UHFFFAOYSA-N
SMILES： Cc1cc(=O)c2c(O)c3c(O)cc(O)c(c4c(O)cc(O)c5c(O)c6c(cc45)oc(C)cc6=O)c3cc2o1
Systematic name  (2)：
  • (aR)-5,5′,6,6′,8,8′-ヘキサヒドロキシ-2,2′-ジメチル[9,9′-ビ[4H-ナフト[2,3-b]ピラン]]-4,4′-ジオン
  • (aR)-5,5′,6,6′,8,8′-ヘキサヒドロキシ-2,2′-ジメチル-9,9′-ビ[4H-ナフト[2,3-b]ピラン]-4,4′-ジオン
Other name (3)：
  • ウスチラギノイジンA
  • Ustilaginoidin A
  • (aR)-5,5′,6,6′,8,8′-Hexahydroxy-2,2′-dimethyl-9,9′-bi[4H-naphtho[2,3-b]pyran]-4,4′-dione
CAS registry number： 3692-07-7
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