SpectraBase Compound ID | 13wkE0sYJSA |
---|---|
InChI | InChI=1S/C31H46O5/c1-18(2)14-20(32)15-19(3)21-10-12-30(7)22(21)16-23-26-29(6,17-25(33)36-23)24(11-13-31(26,30)8)28(4,5)27(34)35-9/h14-15,21-24,26H,10-13,16-17H2,1-9H3/b19-15+/t21-,22-,23-,24+,26-,29+,30-,31-/m1/s1 |
InChIKey | SPMYJPIKJGOLOZ-YHQFMBKISA-N |
Mol Weight | 498.7 g/mol |
Molecular Formula | C31H46O5 |
Exact Mass | 498.334525 g/mol |
SpectraBase Spectrum ID | 4pi6G6XdxVi |
---|---|
Name | VIBURNUDIENONE-B1-METHYLESTER |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C31H46O5 |
InChI | InChI=1S/C31H46O5/c1-18(2)14-20(32)15-19(3)21-10-12-30(7)22(21)16-23-26-29(6,17-25(33)36-23)24(11-13-31(26,30)8)28(4,5)27(34)35-9/h14-15,21-24,26H,10-13,16-17H2,1-9H3/b19-15+/t21-,22-,23-,24+,26-,29+,30-,31-/m1/s1 |
InChIKey | SPMYJPIKJGOLOZ-YHQFMBKISA-N |
Literature Reference Author | K.MACHIDA,M.KIKUCHI |
Literature Reference Citation | CHEM.PHARM.BULL.,47,692(1999) |
Literature Reference DOI | 10.1248/cpb.47.692 |
Molecular Weight | 498.703 g/mol |
Solvent | CDCl3 |
Source File Reference | UWLU8002 |