| SpectraBase Compound ID | Atv7u4nsdhR |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8-9,21-23,31H,10-18H2,1-7H3,(H,32,33)/t21?,22?,23-,27+,28-,29-,30+/m1/s1 |
| InChIKey | XMOMYSSKYVFTKO-NPFOLJKPSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9GkNAZRkPnh |
|---|---|
| Name | 3-ALPHA-HYDROXYOLEANE-11:13(18)-DIEN-28-OIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8-9,21-23,31H,10-18H2,1-7H3,(H,32,33)/t21?,22?,23-,27+,28-,29-,30+/m1/s1 |
| InChIKey | XMOMYSSKYVFTKO-NPFOLJKPSA-N |
| Literature Reference Author | C.G.CALDWELL,S.G.FRANZBLAU,E.SUAREZ,B.N.TIMMERMANN |
| Literature Reference Citation | J.NAT.PROD.,63,1611(2000) |
| Literature Reference DOI | 10.1021/np0002233 |
| Molecular Weight | 454.693 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWRU2305 |