| SpectraBase Compound ID | 1o89UuYrNTS |
|---|---|
| InChI | InChI=1S/C33H50O6/c1-20(2)23-13-14-25-24(31(23,6)17-16-27(35)38-9)15-18-32(7)28(26(34)19-33(25,32)8)22(29(36)39-10)12-11-21(3)30(4,5)37/h14-15,22-23,26,28,34,37H,1,3,11-13,16-19H2,2,4-10H3/t22?,23-,26+,28-,31-,32+,33-/m0/s1 |
| InChIKey | SEHMUCBKPQFAMJ-CEDFEZQJSA-N |
| Mol Weight | 542.8 g/mol |
| Molecular Formula | C33H50O6 |
| Exact Mass | 542.360739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JsGp5hwubnY |
|---|---|
| Name | 16-ALPHA,25-DIHYDROXY-3,4-SECO-LANOSTA-4(28),7,9(11),24(31)-TETRAEN-3,21-DIOIC-ACID-DIMETHYLESTER |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H50O6 |
| InChI | InChI=1S/C33H50O6/c1-20(2)23-13-14-25-24(31(23,6)17-16-27(35)38-9)15-18-32(7)28(26(34)19-33(25,32)8)22(29(36)39-10)12-11-21(3)30(4,5)37/h14-15,22-23,26,28,34,37H,1,3,11-13,16-19H2,2,4-10H3/t22?,23-,26+,28-,31-,32+,33-/m0/s1 |
| InChIKey | SEHMUCBKPQFAMJ-CEDFEZQJSA-N |
| Literature Reference Author | T.TAI,A.AKAHORI,T.SHINGU |
| Literature Reference Citation | PHYTOCHEM.,32,1239(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95099-4 |
| Molecular Weight | 542.756 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU6403 |