input word = C00006135

Metabolite InformationStructural formula
Name Alternanthin
6-(2,6-Dideoxy-beta-L-xylo-hexopyranosyl)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one
Formula C22H22O9
Mw 430.1263823
CAS RN 119269-48-6
C_ID C00006135 ,
InChIKey ZRNTZPKUNIPEAL-OXGIZDJYNA-N
InChICode InChI=1S/C22H22O9/c1-9-21(27)14(26)8-17(30-9)19-13(25)7-18-20(22(19)28)12(24)6-15(31-18)10-3-4-11(23)16(5-10)29-2/h3-7,9,14,17,21,23,25-28H,8H2,1-2H3/t9-,14-,17-,21-/m1/s1
SMILES COc1cc(-c2cc(=O)c3c(O)c([C@@H]4CC(O)[C@H](O)[C@@H](C)O4)c(O)cc3o2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAmaranthaceaeAlternanthera phylloxeroides Ref.
PlantaeDioscoreaceaeDioscorea opposita Ref.
PlantaePoaceaeZea mays Ref.
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