| SpectraBase Compound ID | KqS4zmnpPWw |
|---|---|
| InChI | InChI=1S/C50H92O4/c1-43(34-36-45-44(2)35-37-46-49(3,4)47(52)38-40-50(45,46)5)39-42-54-48(53)33-31-29-27-25-23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-26-28-30-32-41-51/h35,39,45-47,51-52H,6-34,36-38,40-42H2,1-5H3/b43-39+/t45-,46-,47-,50+/m1/s1 |
| InChIKey | LYNURUCHFPYGIL-VZVUCSPASA-N |
| Mol Weight | 757.3 g/mol |
| Molecular Formula | C50H92O4 |
| Exact Mass | 756.699561 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 743q2MZdeoA |
|---|---|
| Name | 15-(OMEGA-HYDROXYTRICONTANOYL)-(-)-LABDA-7,13-DIENE-3,15-DIOL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H92O4 |
| InChI | InChI=1S/C50H92O4/c1-43(34-36-45-44(2)35-37-46-49(3,4)47(52)38-40-50(45,46)5)39-42-54-48(53)33-31-29-27-25-23-21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24-26-28-30-32-41-51/h35,39,45-47,51-52H,6-34,36-38,40-42H2,1-5H3/b43-39+/t45-,46-,47-,50+/m1/s1 |
| InChIKey | LYNURUCHFPYGIL-VZVUCSPASA-N |
| Literature Reference Author | M.TOKI,T.OOI,T.KUSUMI |
| Literature Reference Citation | J.NAT.PROD.,62,1504(1999) |
| Literature Reference DOI | 10.1021/np990170t |
| Molecular Weight | 757.278 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS22712 |