input word = C00003940

Metabolite InformationStructural formula
Name Agehoustin G
Formula C20H20O8
Mw 388.11581762
CAS RN 96410-44-5
C_ID C00003940 ,
InChIKey XXRUPCWFCYTCAP-UHFFFAOYSA-N
InChICode InChI=1S/C20H20O8/c1-23-12-8-15(25-3)14(24-2)6-10(12)13-7-11(21)18-16(28-13)9-17(26-4)20(27-5)19(18)22/h6-9,22H,1-5H3
SMILES c1(c(c(c2c(c1)oc(cc2=O)c1cc(c(cc1OC)OC)OC)O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratum houstonianum Ref.
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