| SpectraBase Compound ID | 324zf5xX8CL |
|---|---|
| InChI | InChI=1S/C29H44O5/c1-16-9-12-29(24(32)33)14-13-26(4)18(23(29)28(16,6)34)7-8-21-25(3)11-10-19(30)17(2)22(25)20(31)15-27(21,26)5/h7,16,19-23,30-31,34H,2,8-15H2,1,3-6H3,(H,32,33)/t16-,19+,20-,21?,22?,23?,25-,26-,27-,28-,29+/m1/s1 |
| InChIKey | VCCSJCPZKYPORJ-RGTNRTMSSA-N |
| Mol Weight | 472.7 g/mol |
| Molecular Formula | C29H44O5 |
| Exact Mass | 472.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HAjC0hSPpzZ |
|---|---|
| Name | 23-NOR-24-ESOMETHYLENE-3-BETA,6-BETA,19-ALPHA-TRIHYDROXY-URS-12-EN-28-OIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H44O5 |
| InChI | InChI=1S/C29H44O5/c1-16-9-12-29(24(32)33)14-13-26(4)18(23(29)28(16,6)34)7-8-21-25(3)11-10-19(30)17(2)22(25)20(31)15-27(21,26)5/h7,16,19-23,30-31,34H,2,8-15H2,1,3-6H3,(H,32,33)/t16-,19+,20-,21?,22?,23?,25-,26-,27-,28-,29+/m1/s1 |
| InChIKey | VCCSJCPZKYPORJ-RGTNRTMSSA-N |
| Literature Reference Author | R.AQUINO,F.DESIMONE,F.F.VINCIERI,C.PIZZA,E.GACS-BAITZ |
| Literature Reference Citation | J.NAT.PROD.,53,559(1990) |
| Literature Reference DOI | 10.1021/np50069a004 |
| Molecular Weight | 472.665 g/mol |
| Solvent | CD3OD:CDCl3 |
| Source File Reference | UWRU314 |