Chem
J-GLOBAL ID：201307009988614122   Nikkaji number：J3.205.732B

1-(4-Isopropylphenyl)-4-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)-1,4-dihydroanthraquinone

1-(4-イソプロピルフェニル)-4-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)-1,4-ジヒドロアントラキノン
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： C37H38O11
Molecular formula furigana： C37-H38-O11
Molecular weight： 658.700
InChI： InChI=1S/C37H38O11/c1-18(2)23-11-13-24(14-12-23)25-15-16-28(31-30(25)32(42)26-9-7-8-10-27(26)33(31)43)34-36(46-21(5)40)37(47-22(6)41)35(45-20(4)39)29(48-34)17-44-19(3)38/h7-16,18,25,28-29,34-37H,17H2,1-6H3/t25?,28?,29-,34+,35-,36+,37+/m1/s1
InChI key： XJFQNTNNRKBPMP-DLJXXQNMSA-N
SMILES： CC(C)c1ccc(cc1)C1C=CC([C@@H]2O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]2OC(=O)C)C2=C1C(=O)c1ccccc1C2=O
Systematic name  (3)：
  • 1-(4-イソプロピルフェニル)-4-(2-O,3-O,4-O,6-O-テトラアセチル-β-D-グルコピラノシル)-1,4-ジヒドロアントラキノン
  • [(2R,3R,4R,5S,6S)-3,4,5-トリス(アセチルオキシ)-6-{9,10-ジオキソ-4-[4-(プロパン-2-イル)フェニル]-1,4,9,10-テトラヒドロアントラセン-1-イル}オキサン-2-イル]メチル アセタート
  • [(2R,3R,4R,5S,6S)-3,4,5-tris(acetyloxy)-6-{9,10-dioxo-4-[4-(propan-2-yl)phenyl]-1,4,9,10-tetrahydroanthracen-1-yl}oxan-2-yl]methyl acetate
Other name (1)：
  • 1-(4-Isopropylphenyl)-4-(2-O,3-O,4-O,6-O-tetraacetyl-β-D-glucopyranosyl)-1,4-dihydroanthraquinone
Thsaurus map：
Thesaurus Map

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