input word = C00004085

Metabolite InformationStructural formula
Name Agecorynin G
2-(3-Hydroxy-2,4,5-trimethoxyphenyl)-5,6,7-trimethoxy-4H-1-benzopyran-4-one
Formula C21H22O9
Mw 418.1263823
CAS RN 144525-24-6
C_ID C00004085 ,
InChIKey LYGDVJBJNCXPRS-UHFFFAOYSA-N
InChICode InChI=1S/C21H22O9/c1-24-14-7-10(18(26-3)17(23)19(14)27-4)12-8-11(22)16-13(30-12)9-15(25-2)20(28-5)21(16)29-6/h7-9,23H,1-6H3
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1cc(c(c(c1OC)O)OC)OC)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratum corymbosum Ref.
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