Chem
J-GLOBAL ID：201207021667042600   Nikkaji number：J3.042.192B

(2S,3R,4S,5R)-2,3,5-Trihydroxy-4-[[3-(3-methoxy-4-hydroxyphenyl)acryloyl]oxy]hexanedioic acid dimethyl ester

(2S,3R,4S,5R)-2,3,5-トリヒドロキシ-4-[[3-(3-メトキシ-4-ヒドロキシフェニル)アクリロイル]オキシ]ヘキサン二酸ジメチル
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： C18H22O11
Molecular formula furigana： C18-H22-O11
Molecular weight： 414.363
InChI： InChI=1S/C18H22O11/c1-26-11-8-9(4-6-10(11)19)5-7-12(20)29-16(15(23)18(25)28-3)13(21)14(22)17(24)27-2/h4-8,13-16,19,21-23H,1-3H3/t13-,14+,15-,16+/m1/s1
InChI key： LAUMTUBRFVOUTM-QXSJWSMHSA-N
SMILES： COC(=O)[C@@H](O)[C@@H](O)[C@H](OC(=O)C=Cc1ccc(O)c(OC)c1)[C@@H](O)C(=O)OC
Systematic name  (3)：
  • (2S,3R,4S,5R)-2,3,5-トリヒドロキシ-4-[[3-(3-メトキシ-4-ヒドロキシフェニル)アクリロイル]オキシ]ヘキサン二酸ジメチル
  • 1,6-ジメチル (2S,3R,4S,5R)-2,3,5-トリヒドロキシ-4-{[3-(4-ヒドロキシ-3-メトキシフェニル)プロパ-2-エノイル]オキシ}ヘキサンジオアート
  • 1,6-dimethyl (2S,3R,4S,5R)-2,3,5-trihydroxy-4-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}hexanedioate
Other name (1)：
  • (2S,3R,4S,5R)-2,3,5-Trihydroxy-4-[[3-(3-methoxy-4-hydroxyphenyl)acryloyl]oxy]hexanedioic acid dimethyl ester
Thsaurus map：
Thesaurus Map

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