input word = C00019749

Metabolite InformationStructural formula
Name Mirabijalone C
5,2',3'-Trihydroxy-7-methoxy-2-hydroxymethyl-6-methylisoflavone 3'-O-glucoside
Formula C24H26O12
Mw 506.1424263
CAS RN 485811-83-4
C_ID C00019749 ,
InChIKey PXXCXVDZVUBKLO-GVCLXSOTNA-N
InChICode InChI=1S/C24H26O12/c1-9-12(33-2)6-13-17(18(9)27)21(30)16(14(7-25)34-13)10-4-3-5-11(19(10)28)35-24-23(32)22(31)20(29)15(8-26)36-24/h3-6,15,20,22-29,31-32H,7-8H2,1-2H3/t15-,20-,22+,23-,24-/m1/s1
SMILES COc1cc2oc(CO)c(-c3cccc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3O)c(=O)c2c(O)c1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeNyctaginaceaeMirabilis jalapa Ref.
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