Chem
J-GLOBAL ID：200907052196206434   Nikkaji number：J1.234.693J

CKD-731

3,4,5-トリメトキシ-trans-けい皮酸(3R)-4β-[(2R,3R)-2-メチル-3-(3-メチル-2-ブテニル)オキシラニル]-5α-メトキシ-1-オキサスピロ[2.5]オクタン-6α-イル
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： C28H38O8
Molecular formula furigana： C28-H38-O8
Molecular weight： 502.604
InChI： InChI=1S/C28H38O8/c1-17(2)8-10-22-27(3,36-22)26-25(33-7)19(12-13-28(26)16-34-28)35-23(29)11-9-18-14-20(30-4)24(32-6)21(15-18)31-5/h8-9,11,14-15,19,22,25-26H,10,12-13,16H2,1-7H3/b11-9+/t19-,22-,25-,26-,27+,28+/m1/s1
InChI key： YALIVVKJRYVKNB-GGHPKCFRSA-N
SMILES： CO[C@@H]1[C@@H](CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C)OC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1
Systematic name  (3)：
  • 3,4,5-トリメトキシ-trans-けい皮酸(3R)-4β-[(2R,3R)-2-メチル-3-(3-メチル-2-ブテニル)オキシラニル]-5α-メトキシ-1-オキサスピロ[2.5]オクタン-6α-イル
  • (3R,4S,5S,6R)-5-メトキシ-4-[(2R,3R)-2-メチル-3-(3-メチルブタ-2-エン-1-イル)オキシラン-2-イル]-1-オキサスピロ[2.5]オクタン-6-イル (2E)-3-(3,4,5-トリメトキシフェニル)プロパ-2-エノアート
  • (3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Other name (2)：
  • 3,4,5-Trimethoxy-trans-cinnamic acid (3R)-4β-[(2R,3R)-2-methyl-3-(3-methyl-2-butenyl)oxiranyl]-5α-methoxy-1-oxaspiro[2.5]octane-6α-yl ester
  • CKD-731
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM