Chem
J-GLOBAL ID：200907089714507193   Nikkaji number：J1.780.700E

LL-783277

2-ヒドロキシ-4-メトキシ-6-[(4S,5S,7E,10S)-4,5,10-トリヒドロキシ-6-オキソ-7-ウンデセニル]安息香酸μ-ラクトン
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： C19H24O7
Molecular formula furigana： C19-H24-O7
Molecular weight： 364.394
InChI： InChI=1S/C19H24O7/c1-11-5-3-7-14(20)18(23)15(21)8-4-6-12-9-13(25-2)10-16(22)17(12)19(24)26-11/h3,7,9-11,15,18,21-23H,4-6,8H2,1-2H3/b7-3+/t11-,15-,18+/m0/s1
InChI key： QXPNJMHRUZCEAP-NIMAELOESA-N
SMILES： COc1cc(O)c2c(CCC[C@H](O)[C@H](O)C(=O)/C=C/C[C@H](C)OC2=O)c1
Systematic name  (5)：
  • 2-ヒドロキシ-4-メトキシ-6-[(4S,5S,7E,10S)-4,5,10-トリヒドロキシ-6-オキソ-7-ウンデセニル]安息香酸μ-ラクトン
  • (3S,5E,8S,9S)-3,4,7,8,9,10,11,12-オクタヒドロ-3-メチル-14-メトキシ-8,9,16-トリヒドロキシ-1H-2-ベンゾオキサシクロテトラデシン-1,7-ジオン
  • (8S,11E)-1,8α,9α-トリヒドロキシ-3-メトキシ-14α-メチル-5,6,7,8,9,10,13,14-オクタヒドロ-16H-15-オキサベンゾシクロテトラデセン-10,16-ジオン
  • (3S,5E,8S,9S)-8,9,16-トリヒドロキシ-14-メトキシ-3-メチル-3,4,7,8,9,10,11,12-オクタヒドロ-1H-2-ベンゾオキサシクロテトラデシン-1,7-ジオン
  • (3S,5E,8S,9S)-8,9,16-trihydroxy-14-methoxy-3-methyl-3,4,7,8,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecine-1,7-dione
Other name (4)：
  • 2-Hydroxy-4-methoxy-6-[(4S,5S,7E,10S)-4,5,10-trihydroxy-6-oxo-7-undecenyl]benzoic acid μ-lactone
  • (3S,5E,8S,9S)-3,4,7,8,9,10,11,12-Octahydro-3-methyl-14-methoxy-8,9,16-trihydroxy-1H-2-benzooxacyclotetradecin-1,7-dione
  • LL-783277
  • (8S,11E)-1,8α,9α-Trihydroxy-3-methoxy-14α-methyl-5,6,7,8,9,10,13,14-octahydro-16H-15-oxabenzocyclotetradecene-10,16-dione
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