input word = C00012876

Metabolite InformationStructural formula
Name Ursialpinolide
[1aR-(1aalpha,3aalpha,4abeta,7abeta,8abeta,8balpha)]-1a,4,4a,7,7a,8,8a,8b-Octahydro-3a,8b-dimethyl-7-methyleneoxireno[5,6]naphtho[2,3-b]furan-6(3aH)-one
Formula C15H18O3
Mw 246.12559444
CAS RN 75627-96-2
C_ID C00012876 ,
InChIKey KDZGOEXAKYNKRO-FYNNZVGDNA-N
InChICode InChI=1S/C15H18O3/c1-8-9-6-11-14(2,7-10(9)17-13(8)16)5-4-12-15(11,3)18-12/h4-5,9-12H,1,6-7H2,2-3H3/t9-,10-,11-,12-,14+,15+/m1/s1
SMILES C1[C@]2([C@@H](C[C@H]3[C@@H]1OC(=O)C3=C)[C@]1([C@@H](C=C2)O1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeUrsinia alpina Ref.
PlantaeAsteraceaeUrsinia anthemoides Ref.
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