Chem
J-GLOBAL ID：200907026336122812   Nikkaji number：J92.022C

Cladospolide A

クラドスポリド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： C12H20O4
Molecular formula furigana： C12-H20-O4
Molecular weight： 228.288
InChI： InChI=1S/C12H20O4/c1-9-5-3-2-4-6-10(13)11(14)7-8-12(15)16-9/h7-11,13-14H,2-6H2,1H3/b8-7+/t9?,10-,11+/m0/s1
InChI key： PLHJPQNLCWFPFY-XNPXJUNISA-N
SMILES： CC1CCCCC[C@H](O)[C@H](O)/C=C/C(=O)O1
Systematic name  (3)：
  • (3E,5R,6S,12R)-5,6-ジヒドロキシ-12-メチルオキサシクロドデカ-3-エン-2-オン
  • (3E,5R,6S,12R)-5,6-ジヒドロキシ-12-メチル-1-オキサシクロドデカ-3-エン-2-オン
  • (3E,5R,6S,12R)-5,6-dihydroxy-12-methyl-1-oxacyclododec-3-en-2-one
Other name (5)：
  • Cladospolide A
  • クラドスポリドA
  • (3E,5R,6S,12R)-5,6-Dihydroxy-12-methyloxacyclododeca-3-en-2-one
  • (-)-クラドスポリドA
  • (-)-Cladospolide A
CAS registry number： 77663-54-8
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