input word = C00005786

Metabolite InformationStructural formula
Name Limocitrol 3-[alpha-L-arabinopyranosyl-(1->3)[galactosyl-(1->6)]-galactoside]
Formula C35H44O23
Mw 832.22733772
CAS RN 153976-17-1
C_ID C00005786 ,
InChIKey ZHVDHQATSYKXHK-WFDQAUITNA-N
InChICode InChI=1S/C35H44O23/c1-49-13-6-10(4-5-11(13)37)27-32(21(43)16-20(42)29(50-2)25(47)31(51-3)28(16)56-27)58-35-26(48)30(57-34-23(45)17(39)12(38)8-52-34)19(41)15(55-35)9-53-33-24(46)22(44)18(40)14(7-36)54-33/h4-6,12,14-15,17-19,22-24,26,30,33-42,44-48H,7-9H2,1-3H3/t12-,14+,15-,17-,18-,19-,22-,23-,24+,26+,30-,33+,34+,35-/m0/s1
SMILES COc1cc(-c2oc3c(OC)c(O)c(OC)c(O)c3c(=O)c2O[C@@H]2OC(CO[C@@H]3OC(CO)[C@H](O)[C@H](O)C3O)[C@H](O)[C@H](O[C@@H]3OC[C@H](O)[C@H](O)C3O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMillettia pinnata Ref.
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OrganismMillettia pinnata
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Agrawal,Int.J.Pharmacogn.,31,(1993),305