| SpectraBase Compound ID | KohVDMqfWtw |
|---|---|
| InChI | InChI=1S/C34H52O6/c1-20(35)39-27-14-17-32(6)23-10-12-25-31(5,19-22(23)9-11-24(32)30(27,3)4)16-13-26-33(25,7)18-15-28(40-21(2)36)34(26,8)29(37)38/h9,23-28H,10-19H2,1-8H3,(H,37,38)/t23-,24-,25-,26+,27+,28-,31-,32+,33+,34+/m1/s1 |
| InChIKey | UYVNNJBTWBXJBQ-DTLBNAHSSA-N |
| Mol Weight | 556.8 g/mol |
| Molecular Formula | C34H52O6 |
| Exact Mass | 556.376389 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8B29UaSAfyF |
|---|---|
| Name | LYCERNUIC-ACID-A-DIACETATE |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H52O6 |
| InChI | InChI=1S/C34H52O6/c1-20(35)39-27-14-17-32(6)23-10-12-25-31(5,19-22(23)9-11-24(32)30(27,3)4)16-13-26-33(25,7)18-15-28(40-21(2)36)34(26,8)29(37)38/h9,23-28H,10-19H2,1-8H3,(H,37,38)/t23-,24-,25-,26+,27+,28-,31-,32+,33+,34+/m1/s1 |
| InChIKey | UYVNNJBTWBXJBQ-DTLBNAHSSA-N |
| Literature Reference Author | Z.ZHANG,H.N.ELSOHLY,M.R.JACOB,D.S.PASCO,L.A.WALKER,A.M.CLARK |
| Literature Reference Citation | J.NAT.PROD.,65,979(2002) |
| Literature Reference DOI | 10.1021/np0200616 |
| Molecular Weight | 556.783 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI4364 |