Chem
J-GLOBAL ID:200907040909470384   Nikkaji number:J1.389.516C

(3R)-3α-Methyl-5α,12,14-trihydroxy-3,4,5,6,7,8,9,10-octahydro-1H-2-benzooxacyclododecin-1-one

(3R)-3α-メチル-5α,12,14-トリヒドロキシ-3,4,5,6,7,8,9,10-オクタヒドロ-1H-2-ベンゾオキサシクロドデシン-1-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: C16H22O5
Molecular formula furigana: C16-H22-O5
Molecular weight: 294.347
InChI: InChI=1S/C16H22O5/c1-10-7-12(17)6-4-2-3-5-11-8-13(18)9-14(19)15(11)16(20)21-10/h8-10,12,17-19H,2-7H2,1H3/t10-,12?/m1/s1
InChI key: PQJJJIPGQCKGDU-RWANSRKNSA-N
SMILES: C[C@@H]1CC(O)CCCCCc2cc(O)cc(O)c2C(=O)O1
Systematic name  (5):
  • (3R,5R)-3,4,5,6,7,8,9,10-オクタヒドロ-5,12,14-トリヒドロキシ-3-メチル-1H-2-ベンゾオキサシクロドデシン-1-オン
  • (7R)-2,4,9α-トリヒドロキシ-7α-メチル-7,8,9,10,11,12,13,14-オクタヒドロ-5H-6-オキサベンゾシクロドデセン-5-オン
  • (3R)-3α-メチル-5α,12,14-トリヒドロキシ-3,4,5,6,7,8,9,10-オクタヒドロ-1H-2-ベンゾオキサシクロドデシン-1-オン
  • (3R,5R)-5,12,14-トリヒドロキシ-3-メチル-3,4,5,6,7,8,9,10-オクタヒドロ-1H-2-ベンゾオキサシクロドデシン-1-オン
  • (3R,5R)-5,12,14-trihydroxy-3-methyl-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclododecin-1-one
Other name (3):
  • (3R,5R)-3,4,5,6,7,8,9,10-Octahydro-5,12,14-trihydroxy-3-methyl-1H-2-benzoxacyclododecin-1-one
  • (7R)-2,4,9α-Trihydroxy-7α-methyl-7,8,9,10,11,12,13,14-octahydro-5H-6-oxabenzocyclododecene-5-one
  • (3R)-3α-Methyl-5α,12,14-trihydroxy-3,4,5,6,7,8,9,10-octahydro-1H-2-benzooxacyclododecin-1-one
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