input word = C00023443

Metabolite InformationStructural formula
Name Koanophyllic acid C
Formula C20H28O4
Mw 332.19875938
CAS RN 80368-51-0
C_ID C00023443 ,
InChIKey MZTWBVITFAFIPW-IXGQTMDRNA-N
InChICode InChI=1S/C20H28O4/c1-13-6-7-16-15(5-4-10-20(16,3)18(22)23)19(13,2)11-8-14-9-12-24-17(14)21/h7,9,13,15H,4-6,8,10-12H2,1-3H3,(H,22,23)/t13-,15+,19+,20+/m0/s1
SMILES C1C[C@@](C2=CC[C@@H]([C@]([C@@H]2C1)(CCC1=CCOC1=O)C)C)(C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeKoanophyllon adamantium Ref.
PlantaeAsteraceaeKoanophyllon conglobatum Ref.
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