Chem
J-GLOBAL ID：201407006805600312   Nikkaji number：J3.258.562K

Curcumin β-D-glucuronide

クルクミンモノグルクロニド
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： C27H28O12
Molecular formula furigana： C27-H28-O12
Molecular weight： 544.509
InChI： InChI=1S/C27H28O12/c1-36-20-11-14(5-9-18(20)30)3-7-16(28)13-17(29)8-4-15-6-10-19(21(12-15)37-2)38-27-24(33)22(31)23(32)25(39-27)26(34)35/h3-13,22-25,27-28,30-33H,1-2H3,(H,34,35)/b7-3+,8-4+,16-13-/t22-,23-,24+,25-,27+/m0/s1
InChI key： ISDDQQPRTHCEGT-XANUIUACSA-N
SMILES： COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)c(OC)c2)/O)ccc1O
Systematic name  (3)：
  • [2-メトキシ-4-[(1E,4Z,6E)-3-オキソ-5-ヒドロキシ-7-(3-メトキシ-4-ヒドロキシフェニル)-1,4,6-ヘプタトリエニル]フェニル]β-D-グルコピラノシドウロン酸
  • (2S,3S,4S,5R,6S)-3,4,5-トリヒドロキシ-6-{4-[(1E,4Z,6E)-5-ヒドロキシ-7-(4-ヒドロキシ-3-メトキシフェニル)-3-オキソヘプタ-1,4,6-トリエン-1-イル]-2-メトキシフェノキシ}オキサン-2-カルボン酸
  • (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{4-[(1E,4Z,6E)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-3-oxohepta-1,4,6-trien-1-yl]-2-methoxyphenoxy}oxane-2-carboxylic acid
Other name (5)：
  • [2-Methoxy-4-[(1E,4Z,6E)-3-oxo-5-hydroxy-7-(3-methoxy-4-hydroxyphenyl)-1,4,6-heptatrienyl]phenyl]β-D-glucopyranosiduronic acid
  • クルクミンモノグルクロニド
  • Curcumin monoglucuronide
  • クルクミンβ-D-グルクロニド
  • Curcumin β-D-glucuronide
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