Chem
J-GLOBAL ID：200907065624405077   Nikkaji number：J690.472F

7-Epiloganic acid

7-エピロガン酸
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： C16H24O10
Molecular formula furigana： C16-H24-O10
Molecular weight： 376.358
InChI： InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8+,9+,10+,11+,12-,13+,15-,16-/m0/s1
InChI key： JNNGEAWILNVFFD-DXNVVGTLSA-N
SMILES： C[C@H]1[C@H](O)C[C@H]2[C@@H]1[C@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)O
Systematic name  (4)：
  • (1S)-1,4aα,5,6,7,7aα-ヘキサヒドロ-1α-(β-D-グルコピラノシルオキシ)-6β-ヒドロキシ-7α-メチルシクロペンタ[c]ピラン-4-カルボン酸
  • (1S)-1,4aα,5,6,7,7aα-ヘキサヒドロ-6β-ヒドロキシ-1α-(β-D-グルコピラノシルオキシ)-7α-メチルシクロペンタ[c]ピラン-4-カルボン酸
  • (1S,4aS,6R,7R,7aS)-6-ヒドロキシ-7-メチル-1-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-1H,4aH,5H,6H,7H,7aH-シクロペンタ[c]ピラン-4-カルボン酸
  • (1S,4aS,6R,7R,7aS)-6-hydroxy-7-methyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylic acid
Other name (6)：
  • 7-epi-エピロガニン酸
  • 7-epi-Lloganic acid
  • (1S)-1,4aα,5,6,7,7aα-Hexahydro-1α-(β-D-glucopyranosyloxy)-6β-hydroxy-7α-methylcyclopenta[c]pyran-4-carboxylic acid
  • (1S)-1,4aα,5,6,7,7aα-Hexahydro-6β-hydroxy-1α-(β-D-glucopyranosyloxy)-7α-methylcyclopenta[c]pyran-4-carboxylic acid
  • 7-Epiloganic acid
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KEGG COMPOUND： C11661
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