input word = C00020953

Metabolite InformationStructural formula
Name Virginolide
Formula C15H16O3
Mw 244.10994438
CAS RN 7430-29-7
C_ID C00020953 ,
InChIKey QRVNJKUZIQULFW-MLDCOLDMNA-N
InChICode InChI=1S/C15H16O3/c1-7-4-12(16)14-8(2)5-13-11(6-10(7)14)9(3)15(17)18-13/h4,10-11,13H,3,5-6H2,1-2H3/t10-,11+,13+/m0/s1
SMILES C12=C(C[C@@H]3[C@H](C[C@H]1C(=CC2=O)C)C(=C)C(=O)O3)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium virginicum Ref.
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