Chem
J-GLOBAL ID：201207064650216044   Nikkaji number：J3.009.456E

4-Hydroxyphenyl 6-O-[5-O-(4-aminobenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranoside

4-ヒドロキシフェニル6-O-[5-O-(4-アミノベンゾイル)-D-アピオ-β-D-フラノシル]-β-D-グルコピラノシド
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： C24H29NO12
Molecular formula furigana： C24-H29-N-O12
Molecular weight： 523.491
InChI： InChI=1S/C24H29NO12/c25-13-3-1-12(2-4-13)21(31)34-10-24(32)11-35-23(20(24)30)33-9-16-17(27)18(28)19(29)22(37-16)36-15-7-5-14(26)6-8-15/h1-8,16-20,22-23,26-30,32H,9-11,25H2/t16-,17-,18+,19-,20+,22-,23-,24-/m1/s1
InChI key： CCPWGASEKMGVHV-HVZVMQSSSA-N
SMILES： Nc1ccc(cc1)C(=O)OC[C@@]1(O)CO[C@@H](OC[C@H]2O[C@@H](Oc3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O
Systematic name  (3)：
  • 4-ヒドロキシフェニル6-O-[5-O-(4-アミノベンゾイル)-D-アピオ-β-D-フラノシル]-β-D-グルコピラノシド
  • [(3S,4R,5R)-3,4-ジヒドロキシ-5-{[(2R,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-(4-ヒドロキシフェノキシ)オキサン-2-イル]メトキシ}オキソラン-3-イル]メチル 4-アミノベンゾアート
  • [(3S,4R,5R)-3,4-dihydroxy-5-{[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxyphenoxy)oxan-2-yl]methoxy}oxolan-3-yl]methyl 4-aminobenzoate
Other name (1)：
  • 4-Hydroxyphenyl 6-O-[5-O-(4-aminobenzoyl)-D-apio-β-D-furanosyl]-β-D-glucopyranoside
Thsaurus map：
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