Chem
J-GLOBAL ID：200907049747584434   Nikkaji number：J2.379.935I

Flossonol

フロッソノール
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： C13H16O3
Molecular formula furigana： C13-H16-O3
Molecular weight： 220.268
InChI： InChI=1S/C13H16O3/c1-7-4-10-9(6-12(7)16-3)11(14)5-8(2)13(10)15/h4,6,8,11,14H,5H2,1-3H3/t8-,11+/m1/s1
InChI key： UCEGSXPHVOXHBN-KCJUWKMLSA-N
SMILES： COc1cc2[C@@H](O)C[C@@H](C)C(=O)c2cc1C
Systematic name  (3)：
  • (2R,4S)-3,4-ジヒドロ-4-ヒドロキシ-6-メトキシ-2,7-ジメチル-1(2H)-ナフタレノン
  • (2R,4S)-4-ヒドロキシ-6-メトキシ-2,7-ジメチル-1,2,3,4-テトラヒドロナフタレン-1-オン
  • (2R,4S)-4-hydroxy-6-methoxy-2,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-one
Other name (3)：
  • (2R,4S)-3,4-Dihydro-4-hydroxy-6-methoxy-2,7-dimethyl-1(2H)-naphthalenone
  • フロッソノール
  • Flossonol
CAS registry number： 112936-00-2
KEGG COMPOUND： C09928
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