input word = C00020003

Metabolite InformationStructural formula
Name Praealtin A
Formula C21H24O5
Mw 356.16237388
CAS RN 123564-53-4
C_ID C00020003 ,
InChIKey CUPDSIYSUFFHEY-ZSFWTHPBNA-N
InChICode InChI=1S/C21H24O5/c1-13-5-9-19(25-14(2)22)21(3,4)17(13)12-24-16-8-6-15-7-10-20(23)26-18(15)11-16/h6-8,10-11,17,19H,1,5,9,12H2,2-4H3/t17-,19+/m0/s1
SMILES C=C1CC[C@@H](OC(C)=O)C(C)(C)[C@H]1COc1ccc2ccc(=O)oc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAster praealtus Ref.
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