Chem
J-GLOBAL ID：200907037456902864   Nikkaji number：J2.462.373D

Platencin

プラテンシン
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： C24H27NO6
Molecular formula furigana： C24-H27-N-O6
Molecular weight： 425.481
InChI： InChI=1S/C24H27NO6/c1-13-12-24-9-5-14(13)11-17(24)23(2,18(27)6-10-24)8-7-19(28)25-20-16(26)4-3-15(21(20)29)22(30)31/h3-4,6,10,14,17,26,29H,1,5,7-9,11-12H2,2H3,(H,25,28)(H,30,31)/t14-,17-,23-,24+/m0/s1
InChI key： DWUHGPPFFABTIY-RLWZQHMASA-N
SMILES： C[C@]1(CCC(=O)Nc2c(O)ccc(C(=O)O)c2O)[C@@H]2C[C@@H]3CC[C@]2(CC3=C)C=CC1=O
Systematic name  (4)：
  • 2,4-ジヒドロキシ-3-[3-[(1S)-1-メチル-2-オキソ-6-メチレン-4aβ,7β-エタノ-1,2,4a,5,6,7,8,8aα-オクタヒドロナフタレン-1α-イル]プロパノイルアミノ]安息香酸
  • 2,4-ジヒドロキシ-3-[[3-[(1S,5S,6R,8S)-4-オキソ-5-メチル-9-メチレントリシクロ[6.2.2.01,6]ドデカ-2-エン-5-イル]プロピオニル]アミノ]安息香酸
  • 2,4-ジヒドロキシ-3-{3-[(1S,5S,6R,8S)-5-メチル-9-メチリデン-4-オキソトリシクロ[6.2.2.01,6]ドデカ-2-エン-5-イル]プロパンアミド}安息香酸
  • 2,4-dihydroxy-3-{3-[(1S,5S,6R,8S)-5-methyl-9-methylidene-4-oxotricyclo[6.2.2.01,6]dodec-2-en-5-yl]propanamido}benzoic acid
Other name (6)：
  • 2,4-Dihydroxy-3-[3-[(1S)-1-methyl-2-oxo-6-methylene-4aβ,7β-ethano-1,2,4a,5,6,7,8,8aα-octahydronaphthalene-1α-yl]propanoylamino]benzoic acid
  • プラテンシン
  • Platencin
  • 2,4-Dihydroxy-3-[[3-[(1S,5S,6R,8S)-4-oxo-5-methyl-9-methylenetricyclo[6.2.2.01,6]dodeca-2-ene-5-yl]propionyl]amino]benzoic acid
  • (-)-プラテンシン
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