Chem
J-GLOBAL ID：200907095730745797   Nikkaji number：J643.333B

6-epi-Ophiobolin A

6-epi-オフィオボリン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： C25H36O4
Molecular formula furigana： C25-H36-O4
Molecular weight： 400.559
InChI： InChI=1S/C25H36O4/c1-15(2)10-18-11-16(3)25(29-18)9-8-23(4)12-19-22(20(27)13-24(19,5)28)17(14-26)6-7-21(23)25/h6,10,14,16,18-19,21-22,28H,7-9,11-13H2,1-5H3/t16-,18-,19-,21+,22-,23+,24+,25-/m0/s1
InChI key： MWYYLZRWWNBROW-LQFIJWNTSA-N
SMILES： C[C@H]1C[C@@H](O[C@]21CC[C@]1(C)C[C@H]3[C@@H](C(=O)C[C@@]3(C)O)C(=CC[C@@H]21)C=O)C=C(C)C
Systematic name  (4)：
  • (6α,18R)-14,18-エポキシ-3-ヒドロキシ-5-オキソオフィオボラ-7,19-ジエン-25-アール
  • (6R,18R)-3-ヒドロキシ-5-オキソ-14,18-エポキシオフィオボラ-7,19-ジエン-25-アール
  • (1'S,2S,3S,3'R,5R,7'R,11'R,14'R)-14'-ヒドロキシ-3,3',14'-トリメチル-5-(2-メチルプロパ-1-エン-1-イル)-12'-オキソスピロ[オキソラン-2,6'-トリシクロ[9.3.0.03,7]テトラデカン]-9'-エン-10'-カルバルデヒド
  • (1'S,2S,3S,3'R,5R,7'R,11'R,14'R)-14'-hydroxy-3,3',14'-trimethyl-5-(2-methylprop-1-en-1-yl)-12'-oxospiro[oxolane-2,6'-tricyclo[9.3.0.03,7]tetradecan]-9'-ene-10'-carbaldehyde
Other name (3)：
  • 6-epi-オフィオボリンA
  • 6-epi-Ophiobolin A
  • (6R,18R)-3-Hydroxy-5-oxo-14,18-epoxyophiobola-7,19-diene-25-al
Thsaurus map：
Thesaurus Map

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