Chem
J-GLOBAL ID：200907060990513581   Nikkaji number：J2.089.094K

Dichotomoside B

ジコトモシドB
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： C30H40O13
Molecular formula furigana： C30-H40-O13
Molecular weight： 608.637
InChI： InChI=1S/C30H40O13/c1-4-5-10-41-24(34)9-7-17-12-19(18-11-16(6-8-23(32)33)13-20(39-2)25(18)35)29(21(14-17)40-3)43-30-28(38)27(37)26(36)22(15-31)42-30/h11-14,22,26-28,30-31,35-38H,4-10,15H2,1-3H3,(H,32,33)/t22-,26-,27+,28-,30+/m1/s1
InChI key： CQJZSGNCDIJTLR-ZHTDWIAYSA-N
SMILES： CCCCOC(=O)CCc1cc(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(c1)c1cc(CCC(=O)O)cc(OC)c1O
Systematic name  (3)：
  • 5,5′-ジメトキシ-6-(β-D-グルコピラノシルオキシ)-6′-ヒドロキシビフェニル-3,3′-ビスプロピオン酸3-ブチル
  • 3-[5'-(3-ブトキシ-3-オキソプロピル)-6-ヒドロキシ-3',5-ジメトキシ-2'-{[(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}-[1,1'-ビフェニル]-3-イル]プロパン酸
  • 3-[5'-(3-butoxy-3-oxopropyl)-6-hydroxy-3',5-dimethoxy-2'-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[1,1'-biphenyl]-3-yl]propanoic acid
Other name (3)：
  • 5,5′-Dimethoxy-6-(β-D-glucopyranosyloxy)-6′-hydroxybiphenyl-3,3′-bispropionic acid 3-butyl ester
  • ジコトモシドB
  • Dichotomoside B
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM