input word = C00055085

Metabolite InformationStructural formula
Name Artenolide
Formula C30H40O8
Mw 528.27231825
CAS RN 113807-34-4
C_ID C00055085
InChIKey INWDFSUZZFAFBJ-UHFFFAOYSA-N
InChICode InChI=1S/C30H40O8/c1-13-14-6-8-28(4,35)19-17-11-26(2,21(19)22(14)37-24(13)32)12-30(17)15-7-9-27(3,34)16-10-18(31)29(5,36)20(16)23(15)38-25(30)33/h10,13-15,17-18,20,22-23,31,34-36H,6-9,11-12H2,1-5H3
SMILES CC1C(=O)OC2C3=C(C4CC3(C)CC43C(=O)OC4C5C(=CC(O)C5(C)O)C(C)(O)CCC43)C(C)(O)CCC12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia absinthium Ref.
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OrganismArtemisia absinthium
ReferenceOvezdurdyev, A. et al., Khim. Prir. Soedin., 1987, 23, 667

Chem. Nat. Compd. (Engl. Transl.), 553 (isol, pmr, cmr)