Chem
J-GLOBAL ID：200907078919975368
Nikkaji number：J468.834A
3-(β-D-Glucopyranuronosyloxy)-3′,4′,5,5′,7-pentahydroxyflavone
ミリセチン3-グルクロニド
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
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
Molecular formula： C21H18O14
Molecular formula furigana： C21-H18-O14
Molecular weight： 494.361
InChI：
InChI=1S/C21H18O14/c22-6-3-7(23)11-10(4-6)33-17(5-1-8(24)12(26)9(25)2-5)18(13(11)27)34-21-16(30)14(28)15(29)19(35-21)20(31)32/h1-4,14-16,19,21-26,28-30H,(H,31,32)/t14-,15-,16+,19-,21+/m0/s1
InChI key：
MBWOCQLTCWTIJE-ZUGPOPFOSA-N
SMILES：
O[C@H]1[C@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c2cc(O)c(O)c(O)c2)O[C@@H]([C@@H](O)[C@@H]1O)C(=O)O
Systematic name (4)：
- 5,7-ジヒドロキシ-2-(3,4,5-トリヒドロキシフェニル)-4-オキソ-4H-1-ベンゾピラン-3-イルβ-D-グルクロニド
- 3-(β-D-グルコピラヌロノシルオキシ)-3′,4′,5,5′,7-ペンタヒドロキシフラボン
- (2S,3S,4S,5R,6S)-6-{[5,7-ジヒドロキシ-4-オキソ-2-(3,4,5-トリヒドロキシフェニル)-4H-クロメン-3-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-カルボン酸
- (2S,3S,4S,5R,6S)-6-{[5,7-dihydroxy-4-oxo-2-(3,4,5-trihydroxyphenyl)-4H-chromen-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
- 5,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-oxo-4H-1-benzopyran-3-yl β-D-glucuronide
- 3-(β-D-Glucopyranuronosyloxy)-3′,4′,5,5′,7-pentahydroxyflavone
- ミリセチン3-グルクロニド
- Myricetin3-グルクロニド
Return to Previous Page
