input word = C00019261

Metabolite InformationStructural formula
Name 5,7,2',4'-Tetrahydroxy-6,3'-diprenylisoflavone 5-O-(4''-rhamnosylrhamnoside)
Formula C37H46O14
Mw 714.28875618
CAS RN 261914-24-3
C_ID C00019261 ,
InChIKey JGENVPGDAJTEFK-MFBIGSDENA-N
InChICode InChI=1S/C37H46O14/c1-15(2)7-9-20-23(38)12-11-19(28(20)41)22-14-47-25-13-24(39)21(10-8-16(3)4)35(26(25)29(22)42)51-37-33(46)31(44)34(18(6)49-37)50-36-32(45)30(43)27(40)17(5)48-36/h7-8,11-14,17-18,27,30-34,36-41,43-46H,9-10H2,1-6H3/t17-,18-,27-,30-,31-,32-,33-,34-,36-,37-/m0/s1
SMILES CC(C)=CCc1c(O)ccc(-c2coc3cc(O)c(CC=C(C)C)c(O[C@@H]4OC(C)[C@H](O[C@@H]5OC(C)[C@H](O)C(O)[C@@H]5O)C(O)[C@@H]4O)c3c2=O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratum conyzoides Ref.
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