Chem
J-GLOBAL ID：200907098042831158   Nikkaji number：J994.114B

Jasminoside C

ジャスミノシド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： C16H24O7
Molecular formula furigana： C16-H24-O7
Molecular weight： 328.361
InChI： InChI=1S/C16H24O7/c1-8-9(4-10(18)5-16(8,2)3)7-22-15-14(21)13(20)12(19)11(6-17)23-15/h4,11-15,17,19-21H,1,5-7H2,2-3H3/t11-,12-,13+,14-,15-/m1/s1
InChI key： KUSKILNIKZVCRA-UXXRCYHCSA-N
SMILES： CC1(C)CC(=O)C=C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=C
Systematic name  (3)：
  • 3-[(β-D-グルコピラノシルオキシ)メチル]-4-メチレン-5,5-ジメチル-2-シクロヘキセン-1-オン
  • 5,5-ジメチル-4-メチリデン-3-({[(2R,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}メチル)シクロヘキサ-2-エン-1-オン
  • 5,5-dimethyl-4-methylidene-3-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)cyclohex-2-en-1-one
Other name (3)：
  • 3-[(β-D-Glucopyranosyloxy)methyl]-4-methylene-5,5-dimethyl-2-cyclohexene-1-one
  • ジャスミノシドC
  • Jasminoside C
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