| SpectraBase Compound ID | 9pAEV5v0pAH |
|---|---|
| InChI | InChI=1S/C34H54O7/c1-20(35)40-26-13-16-31(6)22(29(26,3)4)12-18-34(39)19-30(5)15-11-24-32(7,23(30)9-10-25(31)34)17-14-27(41-21(2)36)33(24,8)28(37)38/h22-27,39H,9-19H2,1-8H3,(H,37,38)/t22?,23-,24+,25+,26+,27-,30-,31-,32+,33+,34-/m1/s1 |
| InChIKey | ZTKNIOHKWFWGGH-PRHRICTJSA-N |
| Mol Weight | 574.8 g/mol |
| Molecular Formula | C34H54O7 |
| Exact Mass | 574.386954 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | OmcczrsZgL |
|---|---|
| Name | LYCERNUIC-ACID-E-DIACETATE |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H54O7 |
| InChI | InChI=1S/C34H54O7/c1-20(35)40-26-13-16-31(6)22(29(26,3)4)12-18-34(39)19-30(5)15-11-24-32(7,23(30)9-10-25(31)34)17-14-27(41-21(2)36)33(24,8)28(37)38/h22-27,39H,9-19H2,1-8H3,(H,37,38)/t22?,23-,24+,25+,26+,27-,30-,31-,32+,33+,34-/m1/s1 |
| InChIKey | ZTKNIOHKWFWGGH-PRHRICTJSA-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 | 574.799 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI4359 |