Chem
J-GLOBAL ID：200907033091819002   Nikkaji number：J1.055.725I

(1S)-1α-(β-D-Glucopyranosyloxy)-7-(3,4-dimethoxy-trans-cinnamoyloxymethyl)-1,4aα,5,7aα-tetrahydrocyclopenta[c]pyran-4-carboxylic acid

(1S)-1α-(β-D-グルコピラノシルオキシ)-7-(3,4-ジメトキシ-trans-シンナモイルオキシメチル)-1,4aα,5,7aα-テトラヒドロシクロペンタ[c]ピラン-4-カルボン酸
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： C27H32O13
Molecular formula furigana： C27-H32-O13
Molecular weight： 564.540
InChI： InChI=1S/C27H32O13/c1-35-17-7-3-13(9-18(17)36-2)4-8-20(29)37-11-14-5-6-15-16(25(33)34)12-38-26(21(14)15)40-27-24(32)23(31)22(30)19(10-28)39-27/h3-5,7-9,12,15,19,21-24,26-28,30-32H,6,10-11H2,1-2H3,(H,33,34)/b8-4+/t15-,19-,21-,22-,23+,24-,26+,27+/m1/s1
InChI key： DCVLQGZRIUJCDA-KRSCNQDHSA-N
SMILES： COc1ccc(/C=C/C(=O)OCC2=CC[C@H]3[C@@H]2[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C3C(=O)O)cc1OC
Systematic name  (5)：
  • (1S)-1α-(β-D-グルコピラノシルオキシ)-7-(3,4-ジメトキシ-trans-シンナモイルオキシメチル)-1,4aα,5,7aα-テトラヒドロシクロペンタ[c]ピラン-4-カルボン酸
  • (1S)-1α-(β-D-グルコピラノシルオキシ)-7-[(3,4-ジメトキシ-trans-シンナモイルオキシ)メチル]-1,4aα,5,7aα-テトラヒドロシクロペンタ[c]ピラン-4-カルボン酸
  • (1S)-1α-(β-D-グルコピラノシルオキシ)-7-[[(3,4-ジメトキシ-trans-シンナモイル)オキシ]メチル]-1,4aα,5,7aα-テトラヒドロシクロペンタ[c]ピラン-4-カルボン酸
  • (1S,4aS,7aS)-7-({[(2E)-3-(3,4-ジメトキシフェニル)プロパ-2-エノイル]オキシ}メチル)-1-{[(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}-1H,4aH,5H,7aH-シクロペンタ[c]ピラン-4-カルボン酸
  • (1S,4aS,7aS)-7-({[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]oxy}methyl)-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,4aH,5H,7aH-cyclopenta[c]pyran-4-carboxylic acid
Other name (3)：
  • (1S)-1α-(β-D-Glucopyranosyloxy)-7-(3,4-dimethoxy-trans-cinnamoyloxymethyl)-1,4aα,5,7aα-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
  • (1S)-1α-(β-D-Glucopyranosyloxy)-7-[(3,4-dimethoxy-trans-cinnamoyloxy)methyl]-1,4aα,5,7aα-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
  • (1S)-1α-(β-D-Glucopyranosyloxy)-7-[[(3,4-dimethoxy-trans-cinnamoyl)oxy]methyl]-1,4aα,5,7aα-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM