input word = C00030970

Metabolite InformationStructural formula
Name Petasiformin A
Formula C14H16O6S
Mw 312.06675897
CAS RN 815584-79-3
C_ID C00030970 ,
InChIKey AVUZOEYGJPUQDM-VMPITWQZSA-N
InChICode InChI=1S/C14H16O6S/c1-10(2)3-6-12-9-11(5-8-14(15)16)4-7-13(12)20-21(17,18)19/h3-5,7-9H,6H2,1-2H3,(H,15,16)(H,17,18,19)/b8-5+
SMILES c1cc(cc(c1OS(=O)(=O)O)CC=C(C)C)/C=C/C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePetasites formosanus KITAMURA Ref.
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