Chem
J-GLOBAL ID：200907047339920288   Nikkaji number：J1.071.642J

Oxphyllenone B

オキシフィレノンB
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： C12H18O3
Molecular formula furigana： C12-H18-O3
Molecular weight： 210.273
InChI： InChI=1S/C12H18O3/c1-11-5-3-8(13)7-9(11)12(2,15)10(14)4-6-11/h7,10,14-15H,3-6H2,1-2H3/t10-,11+,12+/m1/s1
InChI key： ORLGUEREMYIFNG-WOPDTQHZSA-N
SMILES： C[C@@]1(O)[C@H](O)CC[C@]2(C)CCC(=O)C=C12
Systematic name  (3)：
  • (1S)-1α,2α-ジヒドロキシ-1,4aβ-ジメチル-1,2,3,4,4a,5,6,7-オクタヒドロナフタレン-7-オン
  • (4aR,7R,8S)-7,8-ジヒドロキシ-4a,8-ジメチル-2,3,4,4a,5,6,7,8-オクタヒドロナフタレン-2-オン
  • (4aR,7R,8S)-7,8-dihydroxy-4a,8-dimethyl-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-one
Other name (3)：
  • (1S)-1α,2α-Dihydroxy-1,4aβ-dimethyl-1,2,3,4,4a,5,6,7-octahydronaphthalene-7-one
  • オキシフィレノンB
  • Oxphyllenone B
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