![3-O-[(1''-HYDROXYOCTADECYLOXY)-2'-HYDROXYPROPANOYL]-LUPEOL](/api/spectrum/Hu05cVc7Wn/structure.png?h=300&w=458 "3-O-[(1''-HYDROXYOCTADECYLOXY)-2'-HYDROXYPROPANOYL]-LUPEOL")
| SpectraBase Compound ID | 1jP5QDGzRFH |
|---|---|
| InChI | InChI=1S/C51H90O5/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-44(53)55-36-42(52)46(54)56-43-27-26-40-39(47(43,4)5)30-33-51(9)49(40,7)32-29-41-45-38(37(2)3)28-31-48(45,6)34-35-50(41,51)8/h38-45,52-53H,2,10-36H2,1,3-9H3/t38-,39+,40-,41+,42?,43-,44?,45+,48+,49-,50+,51+/m0/s1 |
| InChIKey | WZPPUJOLNXYTPQ-FTVAZWOASA-N |
| Mol Weight | 783.3 g/mol |
| Molecular Formula | C51H90O5 |
| Exact Mass | 782.678826 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hu05cVc7Wn |
|---|---|
| Name | 3-O-[(1''-HYDROXYOCTADECYLOXY)-2'-HYDROXYPROPANOYL]-LUPEOL |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H90O5 |
| InChI | InChI=1S/C51H90O5/c1-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-44(53)55-36-42(52)46(54)56-43-27-26-40-39(47(43,4)5)30-33-51(9)49(40,7)32-29-41-45-38(37(2)3)28-31-48(45,6)34-35-50(41,51)8/h38-45,52-53H,2,10-36H2,1,3-9H3/t38-,39+,40-,41+,42?,43-,44?,45+,48+,49-,50+,51+/m0/s1 |
| InChIKey | WZPPUJOLNXYTPQ-FTVAZWOASA-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 | 783.273 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ16824 |