input word = C00004305

Metabolite InformationStructural formula
Name Luteolin 7-neohesperidoside-4'-glucoside
Formula C33H40O20
Mw 756.21129372
CAS RN 70404-41-0
C_ID C00004305 ,
InChIKey HPHXLGYVVWVZOW-CYGDSMGBNA-N
InChICode InChI=1S/C33H40O20/c1-10-22(39)25(42)28(45)31(47-10)53-30-27(44)24(41)20(9-35)52-33(30)48-12-5-14(37)21-15(38)7-17(49-18(21)6-12)11-2-3-16(13(36)4-11)50-32-29(46)26(43)23(40)19(8-34)51-32/h2-7,10,19-20,22-37,39-46H,8-9H2,1H3/t10-,19-,20-,22-,23+,24+,25-,26-,27-,28+,29+,30+,31-,32+,33+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(cc1)O[C@@H]1O[C@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)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
PlantaeBurseraceaeHedwigia ciliata Ref.
zoom in