input word = C00039374

Metabolite InformationStructural formula
Name Hispitolide C
Formula C20H26O6
Mw 362.17293856
CAS RN 928046-01-9
C_ID C00039374 ,
InChIKey NUZCELOKUVBKSF-IYAWBJETNA-N
InChICode InChI=1S/C20H26O6/c1-5-11(2)17(22)25-10-13-6-7-14-12(3)18(23)26-16(14)19(4)15(21)8-9-20(13,19)24/h5,13-14,16,24H,3,6-10H2,1-2,4H3/b11-5+/t13-,14+,16-,19+,20-/m1/s1
SMILES C=C1C(=O)O[C@@H]2[C@H]1CC[C@H](COC(=O)/C(C)=C/C)[C@]1(O)CCC(=O)[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeParthenium hispitum Ref.
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OrganismParthenium hispitum
ReferenceHu,J.Nat.Prod.,70,(2007),604