| SpectraBase Compound ID | 9x61Cb3Up4X |
|---|---|
| InChI | InChI=1S/C32H48O5/c1-20(33)37-19-29(5)23-10-13-31(7)24(28(23,4)12-11-25(29)34)9-8-21-22-18-27(2,3)14-16-32(22,26(35)36)17-15-30(21,31)6/h18,21,23-24H,8-17,19H2,1-7H3,(H,35,36)/t21?,23?,24?,28-,29+,30+,31+,32-/m0/s1 |
| InChIKey | SJEAJSNWCSDEKP-VQLGKPDISA-N |
| Mol Weight | 512.7 g/mol |
| Molecular Formula | C32H48O5 |
| Exact Mass | 512.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2dWCyMDDf2C |
|---|---|
| Name | ACRIDOCARPUSIC_ACID_B;23-BETA-ACETOXYMORONIC_ACID |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H48O5 |
| InChI | InChI=1S/C32H48O5/c1-20(33)37-19-29(5)23-10-13-31(7)24(28(23,4)12-11-25(29)34)9-8-21-22-18-27(2,3)14-16-32(22,26(35)36)17-15-30(21,31)6/h18,21,23-24H,8-17,19H2,1-7H3,(H,35,36)/t21?,23?,24?,28-,29+,30+,31+,32-/m0/s1 |
| InChIKey | SJEAJSNWCSDEKP-VQLGKPDISA-N |
| Literature Reference Author | S.CAO,R.C.GUZA,J.S.MILLER,R.ANDRIANTSIFERANA,V.E.RASAMISON,D .G.I.KINGSTON |
| Literature Reference Citation | J.NAT.PROD.,67,986(2004) |
| Literature Reference DOI | 10.1021/np040058h |
| Molecular Weight | 512.730 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ5806 |