input word = C00032044

Metabolite InformationStructural formula
Name Myriophylloside D
(-)-Myriophylloside D
Formula C41H44O21
Mw 872.23750847
CAS RN 723334-75-6
C_ID C00032044 ,
InChIKey AEXBYBXMXTZFMW-DOCFFIMANA-N
InChICode InChI=1S/C41H44O21/c1-16-28(47)32(51)34(53)39(57-16)58-21-12-22(44)27-24(13-21)59-36(18-5-9-20(43)10-6-18)37(31(27)50)61-41-38(29(48)23(45)14-56-41)62-40-35(54)33(52)30(49)25(60-40)15-55-26(46)11-4-17-2-7-19(42)8-3-17/h2-13,16,23,25,28-30,32-35,38-45,47-49,51-54H,14-15H2,1H3/b11-4+/t16-,23-,25+,28-,29-,30+,32+,33-,34+,35+,38-,39-,40-,41-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(=O)/C=C/c1ccc(cc1)O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeOxytropis myriophylla Ref.
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OrganismOxytropis myriophylla
ReferenceLu,Chem.Pharm.Bull.,54,(2004),276