Chem
J-GLOBAL ID：201807009326658399   Nikkaji number：J3.704.404K

(-)-Rubiaquinone A

(-)-ルビアキノンA
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： C23H16O5
Molecular formula furigana： C23-H16-O5
Molecular weight： 372.376
InChI： InChI=1S/C23H16O5/c1-12(24)11-23(27)17-9-5-4-8-15(17)21-19(22(23)26)16-10-18(25)13-6-2-3-7-14(13)20(16)28-21/h2-10,25,27H,11H2,1H3/t23-/m0/s1
InChI key： LMWPNTDCJYBERP-QHCPKHFHSA-N
SMILES： CC(=O)C[C@@]1(O)C(=O)c2c(oc3c2cc(O)c2ccccc32)c2ccccc12
Systematic name  (3)：
  • (S)-5,8-ジヒドロキシ-5-アセトニルジナフト[1,2-b:2′,1′-d]フラン-6(5H)-オン
  • (4S)-4,20-ジヒドロキシ-4-(2-オキソプロピル)-12-オキサペンタシクロ[11.8.0.02,11.05,10.014,19]ヘンイコサ-1(13),2(11),5,7,9,14,16,18,20-ノナエン-3-オン
  • (4S)-4,20-dihydroxy-4-(2-oxopropyl)-12-oxapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),5,7,9,14,16,18,20-nonaen-3-one
Other name (3)：
  • (S)-5,8-Dihydroxy-5-acetonyldinaphtho[1,2-b:2′,1′-d]furan-6(5H)-one
  • (-)-ルビアキノンA
  • (-)-Rubiaquinone A
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