Probetaenone I

Probetaenone I is an intermediate in the biosynthesis of the phytotoxin betaenone B from P. betae.Formal Name: 3-hydroxy-1-[(1R,2S,4aR,6S,8R,8aS)-1,2,4a,5,6,7,8,8a-octahydro-1,3,6,8-tetramethyl-2-[(1R)-1-methylpropyl]-1-naphthalenyl]-1-propanone. CAS Number: 115473-44-4. Molecular Formula: C21H36O2. Formula Weight: 320.5. Purity: >95%. Formulation: (Request formulation change), A solid. SMILES: OCCC([C@@]1([C@]2([H])[C@@](C[C@H](C[C@H]2C)C)([H])C=C([C@]1([H])[C@H](C)CC)C)C)=O. InChi Code: InChI=1S/C21H36O2/c1-7-14(3)19-16(5)12-17-11-13(2)10-15(4)20(17)21(19,6)18(23)8-9-22/h12-15,17,19-20,22H,7-11H2,1-6H3/t13-,14+,15+,17+,19-,20-,21-/m0/s1. InChi Key: CWVNYXDUEQFYMM-YDGZXZOGSA-N. Origin: Fungus/Pleospora betae.