Chem
J-GLOBAL ID：201807012093379398   Nikkaji number：J3.722.013B

Ducheside B

ドゥケシドB
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： C20H16O12
Molecular formula furigana： C20-H16-O12
Molecular weight： 448.336
InChI： InChI=1S/C20H16O12/c1-28-15-7(22)2-5-11-10-6(19(27)32-17(11)15)3-8(13(24)16(10)31-18(5)26)29-20-14(25)12(23)9(4-21)30-20/h2-3,9,12,14,20-25H,4H2,1H3/t9-,12-,14+,20+/m0/s1
InChI key： GWJMZVLEUREWIV-WDLYVUMTSA-N
SMILES： COc1c(O)cc2c3c1oc(=O)c1cc(O[C@@H]4O[C@@H](CO)[C@H](O)[C@H]4O)c(O)c(oc2=O)c31
Systematic name  (3)：
  • 3′-メトキシ-4-(α-L-アラビノフラノシルオキシ)-3,4′-ジヒドロキシビフェニル-6,2′:6′,2-ビスカルボラクトン
  • 6-{[(2S,3R,4R,5S)-3,4-ジヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]オキシ}-7,13-ジヒドロキシ-14-メトキシ-2,9-ジオキサテトラシクロ[6.6.2.04,16.011,15]ヘキサデカ-1(15),4,6,8(16),11,13-ヘキサエン-3,10-ジオン
  • 6-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-7,13-dihydroxy-14-methoxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
Other name (3)：
  • 3′-Methoxy-4-(α-L-arabinofuranosyloxy)-3,4′-dihydroxybiphenyl-6,2′:6′,2-biscarbolactone
  • ドゥケシドB
  • Ducheside B
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