input word = C00012213

Metabolite InformationStructural formula
Name Germanin A
Formula C20H26O6
Mw 362.17293856
CAS RN 54927-90-1
C_ID C00012213 ,
InChIKey DKTRFHNKYAUGAY-WBCUMWNENA-N
InChICode InChI=1S/C20H26O6/c1-5-12(3)19(23)25-16-10-14(18(21)22)8-6-7-11(2)9-15-17(16)13(4)20(24)26-15/h8-9,12,15-17H,4-7,10H2,1-3H3,(H,21,22)/b11-9+,14-8+/t12-,15+,16+,17-/m0/s1
SMILES C=C1C(=O)OC2/C=C(C)CC/C=C(/C(=O)O)CC(OC(=O)C(C)CC)C12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula germanica Ref.
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