Chem
J-GLOBAL ID：202107018017340052   Nikkaji number：J3.757.414G

Chaetochiversin C

ケトキベルシンC
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： C18H21ClO8
Molecular formula furigana： C18-H21-CL-O8
Molecular weight： 400.810
InChI： InChI=1S/C18H21ClO8/c1-8(20)4-12(22)13(23)5-9(21)2-3-10-6-11-16(18(26)27-10)14(24)7-15(25)17(11)19/h2-3,6-9,12-13,20-25H,4-5H2,1H3/b3-2+/t8-,9-,12+,13-/m1/s1
InChI key： PWEUDTACGCHZSA-COXCEGNOSA-N
SMILES： c1c(c2c(c(c1O)Cl)cc(oc2=O)/C=C/[C@H](C[C@H]([C@H](C[C@@H](C)O)O)O)O)O
Systematic name  (3)：
  • 3-[(1E,3S,5R,6S,8R)-3,5,6,8-テトラヒドロキシ-1-ノネニル]-5-クロロ-6,8-ジヒドロキシ-1H-2-ベンゾピラン-1-オン
  • 5-クロロ-6,8-ジヒドロキシ-3-[(1E,3S,5R,6S,8R)-3,5,6,8-テトラヒドロキシノナ-1-エン-1-イル]-1H-イソクロメン-1-オン
  • 5-chloro-6,8-dihydroxy-3-[(1E,3S,5R,6S,8R)-3,5,6,8-tetrahydroxynon-1-en-1-yl]-1H-isochromen-1-one
Other name (4)：
  • 5-クロロ-6,8-ジヒドロキシ-3-[(1E,3S,5R,6S,8R)-3,5,6,8-テトラヒドロキシノナ-1-エン-1-イル]イソクロメン-1-オン
  • ケトキベルシンC
  • 5-chloro-6,8-dihydroxy-3-[(1E,3S,5R,6S,8R)-3,5,6,8-tetrahydroxynon-1-en-1-yl]isochromen-1-one
  • Chaetochiversin C
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