input word = C00004940

Metabolite InformationStructural formula
Name Gossypetin 7,4'-dimethyl ether 8-butyrate
Formula C21H20O9
Mw 416.11073224
CAS RN 69306-86-1
C_ID C00004940 ,
InChIKey HYDIJDDPYJAFHX-UHFFFAOYSA-N
InChICode InChI=1S/C21H20O9/c1-4-5-15(24)29-20-14(28-3)9-12(23)16-17(25)18(26)19(30-21(16)20)10-6-7-13(27-2)11(22)8-10/h6-9,22-23,26H,4-5H2,1-3H3
SMILES c1(cc(c2c(c1OC(=O)CCC)oc(c(c2=O)O)c1ccc(c(c1)O)OC)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaeNotholaena affinis Ref.
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