![3-O-[(2'-tetracosyloxy)acetyl]-lupeol](/api/spectrum/5TIdZrR3Nj4/structure.png?h=300&w=458 "3-O-[(2'-tetracosyloxy)acetyl]-lupeol")
| SpectraBase Compound ID | 4KWMDCjCJfv |
|---|---|
| InChI | InChI=1S/C56H100O3/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-42-58-43-50(57)59-49-33-32-47-46(52(49,4)5)36-39-56(9)54(47,7)38-35-48-51-45(44(2)3)34-37-53(51,6)40-41-55(48,56)8/h45-49,51H,2,10-43H2,1,3-9H3/t45-,46+,47-,48+,49-,51+,53+,54-,55+,56+/m0/s1 |
| InChIKey | ISXIIIZYPDOGPJ-JMJIYHCFSA-N |
| Mol Weight | 821.4 g/mol |
| Molecular Formula | C56H100O3 |
| Exact Mass | 820.767247 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TIdZrR3Nj4 |
|---|---|
| Name | 3-O-[2'-(TETRACOSYLOXY)-ACETYL]-LUPEOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H100O3 |
| InChI | InChI=1S/C56H100O3/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-42-58-43-50(57)59-49-33-32-47-46(52(49,4)5)36-39-56(9)54(47,7)38-35-48-51-45(44(2)3)34-37-53(51,6)40-41-55(48,56)8/h45-49,51H,2,10-43H2,1,3-9H3/t45-,46+,47-,48+,49-,51+,53+,54-,55+,56+/m0/s1 |
| InChIKey | ISXIIIZYPDOGPJ-JMJIYHCFSA-N |
| Literature Reference Author | J.FOTIE,D.S.BOHLE,M.L.LEIMANIS,E.GEORGES,G.RUKUNGA,A.E.NKENG FACK |
| Literature Reference Citation | J.NAT.PROD.,69,62(2006) |
| Literature Reference DOI | 10.1021/np050315y |
| Molecular Weight | 821.408 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16823 |