| SpectraBase Compound ID | A0OdM4DBhmr |
|---|---|
| InChI | InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3/t16-,17+,19+,20-,21-,22-,23-,25+,26-,27+,28+,29+/m1/s1 |
| InChIKey | ATPPQNYORHPCJE-OUZPOPPESA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C29H42O4 |
| Exact Mass | 454.30831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Gs8UljPJ4i |
|---|---|
| Name | ILEKUDINOL-A;2-ALPHA,3-BETA-DIHYDROXY-24-NOR-URS-4(23),11-DIEN-28,13-BETA-OLIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H42O4 |
| InChI | InChI=1S/C29H42O4/c1-16-7-11-28-14-13-27(6)26(5)10-8-19-18(3)22(31)20(30)15-25(19,4)21(26)9-12-29(27,33-24(28)32)23(28)17(16)2/h9,12,16-17,19-23,30-31H,3,7-8,10-11,13-15H2,1-2,4-6H3/t16-,17+,19+,20-,21-,22-,23-,25+,26-,27+,28+,29+/m1/s1 |
| InChIKey | ATPPQNYORHPCJE-OUZPOPPESA-N |
| Literature Reference Author | K.NISHIMURA,T.FUKUDA,T.MIYASE,H.NOGUCHI,X.M.CHEN |
| Literature Reference Citation | J.NAT.PROD.,62,1061(1999) |
| Literature Reference DOI | 10.1021/np990019j |
| Molecular Weight | 454.650 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP8669 |