Chem
J-GLOBAL ID：200907047426924290   Nikkaji number：J620.880K

Corallidictyal B

コラリジクチアール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： C22H28O4
Molecular formula furigana： C22-H28-O4
Molecular weight： 356.462
InChI： InChI=1S/C22H28O4/c1-13-6-7-17-20(2,3)8-5-9-21(17,4)22(13)11-14-10-16(24)18(25)15(12-23)19(14)26-22/h10-13,17,24H,5-9H2,1-4H3/t13-,17+,21+,22-/m1/s1
InChI key： XVRIRQMQGOSIKV-DTLARAGXSA-N
SMILES： C[C@@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]21OC1=C(C=O)C(=O)C(=CC1=C2)O
Systematic name  (3)：
  • (1S,4aα)-2α,5,5,8aβ-テトラメチル-5′-ヒドロキシ-6′-オキソスピロ[デカリン-1,2′(6′H)-ベンゾフラン]-7′-カルボアルデヒド
  • (2S,2'R,4'aS,8'aS)-5-ヒドロキシ-2',5',5',8'a-テトラメチル-6-オキソ-3',4',4'a,5',6',7',8',8'a-オクタヒドロ-2'H,6H-スピロ[1-ベンゾフラン-2,1'-ナフタレン]-7-カルバルデヒド
  • (2S,2'R,4'aS,8'aS)-5-hydroxy-2',5',5',8'a-tetramethyl-6-oxo-3',4',4'a,5',6',7',8',8'a-octahydro-2'H,6H-spiro[1-benzofuran-2,1'-naphthalene]-7-carbaldehyde
Other name (3)：
  • コラリジクチアールB
  • Corallidictyal B
  • (1S,4aα)-2α,5,5,8aβ-Tetramethyl-5′-hydroxy-6′-oxospiro[decalin-1,2′(6′H)-benzofuran]-7′-carbaldehyde
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