Chem
J-GLOBAL ID：200907020873411938   Nikkaji number：J1.742.990F

Markhamioside A

マルクハミオシド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： C25H38O16
Molecular formula furigana： C25-H38-O16
Molecular weight： 594.563
InChI： InChI=1S/C25H38O16/c1-10-15(30)17(32)18(33)22(38-10)40-19-16(31)14(7-26)39-23(36-5-4-11-2-3-12(28)13(29)6-11)20(19)41-24-21(34)25(35,8-27)9-37-24/h2-3,6,10,14-24,26-35H,4-5,7-9H2,1H3/t10-,14+,15-,16+,17+,18+,19-,20+,21-,22-,23+,24-,25+/m0/s1
InChI key： OIZGHARLBDZXFQ-YHQCYFESSA-N
SMILES： C[C@@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](OCCc3ccc(O)c(O)c3)[C@@H]2O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 3,4-ジヒドロキシフェネチル2-O-(D-アピオ-β-D-フラノシル)-3-O-(α-L-ラムノピラノシル)-β-D-グルコピラノシド
  • (2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5R,6R)-3-{[(2S,3R,4R)-3,4-ジヒドロキシ-4-(ヒドロキシメチル)オキソラン-2-イル]オキシ}-2-[2-(3,4-ジヒドロキシフェニル)エトキシ]-5-ヒドロキシ-6-(ヒドロキシメチル)オキサン-4-イル]オキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5R,6R)-3-{[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol
Other name (3)：
  • 3,4-Dihydroxyphenethyl 2-O-(D-apio-β-D-furanosyl)-3-O-(α-L-rhamnopyranosyl)-β-D-glucopyranoside
  • Markhamioside A
  • マルクハミオシドA
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