input word = C00003336

Metabolite InformationStructural formula
Name Multiradiatin
Formula C20H22O6
Mw 358.14163844
CAS RN 58262-52-5
C_ID C00003336 ,
InChIKey AUJNARNSAAQNAK-VJVUIGFKNA-N
InChICode InChI=1S/C20H22O6/c1-9(2)8-14(22)25-18-15-11(4)19(24)26-17(15)16(23)10(3)12-6-7-13(21)20(12,18)5/h6-8,10,12,15,17-18H,4H2,1-3,5H3/t10-,12+,15+,17-,18-,20-/m0/s1
SMILES [C@H]12[C@]([C@H]([C@H]3[C@@H](C(=O)[C@H]1C)OC(=O)C3=C)OC(=O)C=C(C)C)(C(=O)C=C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaileya multiradiata Ref.
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