Chem
J-GLOBAL ID:200907060123357879
Nikkaji number:J2.057.121G
Curcumin diglucoside
クルクミンジグルコシド
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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:
C33 H40 O16
Molecular formula furigana:
C33-H40-O16
Molecular weight:
692.667
InChI:
InChI=1S/C33H40O16/c1-44-22-12-20(46-32-30(42)28(40)26(38)24(14-34)48-32)9-5-16(22)3-7-18(36)11-19(37)8-4-17-6-10-21(13-23(17)45-2)47-33-31(43)29(41)27(39)25(15-35)49-33/h3-10,12-13,24-35,38-43H,11,14-15H2,1-2H3/b7-3+,8-4+/t24-,25-,26-,27-,28+,29+,30-,31-,32-,33-/m1/s1
InChI key:
PAJOYVUIFVTCJV-KTQQPIDFSA-N
SMILES:
COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1/C=C/C(=O)CC(=O)/C=C/c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1OC
Systematic name (3):
4,4′-[(1E,6E)-3,5-ジオキソヘプタ-1,6-ジエン-1,7-ジイル]ビス(3-メトキシフェニル)ビスβ-D-グルコピラノシド
(1E,6E)-1,7-ビス(2-メトキシ-4-{[(2S,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}フェニル)ヘプタ-1,6-ジエン-3,5-ジオン
(1E,6E)-1,7-bis(2-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)hepta-1,6-diene-3,5-dione
Other name (3):
4,4′-[(1E,6E)-3,5-Dioxohepta-1,6-diene-1,7-diyl]bis(3-methoxyphenyl)bisβ-D-glucopyranoside
クルクミンジグルコシド
Curcumin diglucoside
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