input word = C00021232

Metabolite InformationStructural formula
Name Guayulin C
Formula C24H30O3
Mw 366.21949482
CAS RN 107812-57-7
C_ID C00021232 ,
InChIKey AEXQMXFOIBLFPN-WBAJNAQNNA-N
InChICode InChI=1S/C24H30O3/c1-15-14-18(27-19(25)11-10-16-8-6-5-7-9-16)21-22(23(21,2)3)20-17(15)12-13-24(20,4)26/h5-11,17-18,20-22,26H,1,12-14H2,2-4H3/b11-10+/t17-,18-,20-,21+,22+,24-/m0/s1
SMILES C1C[C@@H]2[C@H]([C@@]1(C)O)[C@@H]1[C@@H]([C@H](CC2=C)OC(=O)/C=C/c2ccccc2)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeParthenium argentatum Ref.
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