input word = C00030981

Metabolite InformationStructural formula
Name Phellodendric acid A
(+)-Phellodendric acid A
Formula C9H16O5
Mw 204.09977362
CAS RN 917092-50-3
C_ID C00030981 ,
InChIKey IRYKWGXAAUZTJT-JLDDOWRYNA-N
InChICode InChI=1S/C9H16O5/c1-2-3-6-14-9(13)7(10)4-5-8(11)12/h7,10H,2-6H2,1H3,(H,11,12)/t7-/m1/s1
SMILES O(C(=O)[C@@H](CCC(=O)O)O)CCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaePhellodendron amurense Ref.
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