input word = C00011991

Metabolite InformationStructural formula
Name [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid
Formula C19H22O7
Mw 362.13655306
CAS RN 73021-24-6
C_ID C00011991 ,
InChIKey DFMDMXNOBWIBEJ-QVJUQGJLNA-N
InChICode InChI=1S/C19H22O7/c1-8(2)17(22)26-16-15-12(10(4)18(23)25-15)14(21)13(9(3)6-20)19(16,5)11-7-24-11/h6,11-16,21H,1,3-4,7H2,2,5H3/t11-,12-,13+,14+,15+,16+,19+/m0/s1
SMILES [C@H]1([C@H]2[C@H]([C@H]([C@]([C@@H]1C(=C)C=O)(C)[C@@H]1CO1)OC(=O)C(=C)C)OC(=O)C2=C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeZinnia spp. Ref.
zoom in