| SpectraBase Compound ID | H5SUqHtObKN |
|---|---|
| InChI | InChI=1S/C33H54O3/c1-20-19-27(35-10)31(7)17-18-32(8)23(28(31)21(20)2)11-12-25-30(6)15-14-26(36-22(3)34)29(4,5)24(30)13-16-33(25,32)9/h19,21,23-28H,11-18H2,1-10H3/t21-,23?,24?,25?,26+,27+,28?,30+,31+,32-,33-/m1/s1 |
| InChIKey | VBXDQVMGFPRRLF-CVZAFSLZSA-N |
| Mol Weight | 498.8 g/mol |
| Molecular Formula | C33H54O3 |
| Exact Mass | 498.407296 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JOhaIT5mGIo |
|---|---|
| Name | 3-BETA-ACETOXY-22-ALPHA-METHOXY-20-TARAXASTENE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H54O3 |
| InChI | InChI=1S/C33H54O3/c1-20-19-27(35-10)31(7)17-18-32(8)23(28(31)21(20)2)11-12-25-30(6)15-14-26(36-22(3)34)29(4,5)24(30)13-16-33(25,32)9/h19,21,23-28H,11-18H2,1-10H3/t21-,23?,24?,25?,26+,27+,28?,30+,31+,32-,33-/m1/s1 |
| InChIKey | VBXDQVMGFPRRLF-CVZAFSLZSA-N |
| Literature Reference Author | Y.M.CHIANG,Y.H.KUO |
| Literature Reference Citation | J.NAT.PROD.,63,898(2000) |
| Literature Reference DOI | 10.1021/np990630i |
| Molecular Weight | 498.790 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWGE3808 |