Chem
J-GLOBAL ID：200907065907653883   Nikkaji number：J1.667.307B

Glepidotin B

グレピドチン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： C20H20O5
Molecular formula furigana： C20-H20-O5
Molecular weight： 340.375
InChI： InChI=1S/C20H20O5/c1-11(2)8-9-13-14(21)10-15(22)16-17(23)18(24)19(25-20(13)16)12-6-4-3-5-7-12/h3-8,10,18-19,21-22,24H,9H2,1-2H3/t18-,19+/m0/s1
InChI key： ATJOIGKHVRPLSM-RBUKOAKNSA-N
SMILES： CC(=CCc1c(O)cc(O)c2C(=O)[C@H](O)[C@H](Oc12)c1ccccc1)C
Systematic name  (3)：
  • (2R)-3β,5,7-トリヒドロキシ-2,3-ジヒドロ-8-(3-メチル-2-ブテニル)-2α-フェニル-4H-1-ベンゾピラン-4-オン
  • (2R,3R)-3,5,7-トリヒドロキシ-8-(3-メチルブタ-2-エン-1-イル)-2-フェニル-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
  • (2R,3R)-3,5,7-trihydroxy-8-(3-methylbut-2-en-1-yl)-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one
Other name (3)：
  • (2R)-3β,5,7-Trihydroxy-2,3-dihydro-8-(3-methyl-2-butenyl)-2α-phenyl-4H-1-benzopyran-4-one
  • グレピドチンB
  • Glepidotin B
KEGG COMPOUND： C09753
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