Chem
J-GLOBAL ID:200907089863425124   Nikkaji number:J1.929.030A

(4S)-4β-Methyl-8β,11,13-trihydroxy-1,4,5,6,7,8,9,10-octahydro-2H-3-benzoxacyclododecin-2,7,10-trione

(4S)-4β-メチル-8β,11,13-トリヒドロキシ-1,4,5,6,7,8,9,10-オクタヒドロ-2H-3-ベンゾオキサシクロドデシン-2,7,10-トリオン
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: C16H18O7
Molecular formula furigana: C16-H18-O7
Molecular weight: 322.313
InChI: InChI=1S/C16H18O7/c1-8-2-3-11(18)12(19)7-14(21)16-9(5-15(22)23-8)4-10(17)6-13(16)20/h4,6,8,12,17,19-20H,2-3,5,7H2,1H3/t8-,12-/m0/s1
InChI key: PCSBVPMYIHSHPB-UFBFGSQYSA-N
SMILES: C[C@H]1CCC(=O)[C@@H](O)CC(=O)c2c(O)cc(O)cc2CC(=O)O1
Systematic name  (3):
  • (4S)-4β-メチル-8β,11,13-トリヒドロキシ-1,4,5,6,7,8,9,10-オクタヒドロ-2H-3-ベンゾオキサシクロドデシン-2,7,10-トリオン
  • (4S,8S)-8,11,13-トリヒドロキシ-4-メチル-2,4,5,6,7,8,9,10-オクタヒドロ-1H-3-ベンゾオキサシクロドデシン-2,7,10-トリオン
  • (4S,8S)-8,11,13-trihydroxy-4-methyl-2,4,5,6,7,8,9,10-octahydro-1H-3-benzoxacyclododecine-2,7,10-trione
Other name (1):
  • (4S)-4β-Methyl-8β,11,13-trihydroxy-1,4,5,6,7,8,9,10-octahydro-2H-3-benzoxacyclododecin-2,7,10-trione
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