| SpectraBase Compound ID | KkrAATcGAzW |
|---|---|
| InChI | InChI=1S/C32H50O4/c1-18-10-12-29(6)14-15-31(8)21(25(29)19(18)2)16-22(34)26-30(7)17-23(36-20(3)33)27(35)28(4,5)24(30)11-13-32(26,31)9/h11,16,18-19,22-23,25-27,34-35H,10,12-15,17H2,1-9H3/t18-,19+,22-,23-,25?,26?,27+,29-,30+,31-,32-/m1/s1 |
| InChIKey | MLEVHKMQNKPYKX-HGVIUBHASA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C32H50O4 |
| Exact Mass | 498.37091 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7K7enFpahfE |
|---|---|
| Name | 2-ALPHA-ACETOXY-URS-5,12-DIENE-3-BETA,11-ALPHA-DIOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O4 |
| InChI | InChI=1S/C32H50O4/c1-18-10-12-29(6)14-15-31(8)21(25(29)19(18)2)16-22(34)26-30(7)17-23(36-20(3)33)27(35)28(4,5)24(30)11-13-32(26,31)9/h11,16,18-19,22-23,25-27,34-35H,10,12-15,17H2,1-9H3/t18-,19+,22-,23-,25?,26?,27+,29-,30+,31-,32-/m1/s1 |
| InChIKey | MLEVHKMQNKPYKX-HGVIUBHASA-N |
| Literature Reference Author | G.TOPCU,A.ULUBELEN |
| Literature Reference Citation | J.NAT.PROD.,62,1605(1999) |
| Literature Reference DOI | 10.1021/np990165p |
| Molecular Weight | 498.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWRU520 |