input word = C00013520

Metabolite InformationStructural formula
Name 3,7-Dihydroxy-2-[4-hydroxy-3-(4-hydroxy-3-methylbutyl)phenyl]-5,6-dimethoxy-4H-1-benzopyran-4-one
Formula C22H24O8
Mw 416.14711774
CAS RN 343337-04-2
C_ID C00013520 ,
InChIKey QKQBCMSTNUQLPW-UHFFFAOYNA-N
InChICode InChI=1S/C22H24O8/c1-11(10-23)4-5-12-8-13(6-7-14(12)24)20-19(27)18(26)17-16(30-20)9-15(25)21(28-2)22(17)29-3/h6-9,11,23-25,27H,4-5,10H2,1-3H3/t11-/m0/s1
SMILES c12c(oc(c(c1=O)O)c1ccc(c(c1)CC[C@H](C)CO)O)cc(c(c2OC)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVerbenaceaeDuranta repens Ref.
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