| SpectraBase Compound ID | 7anE1gGoaMQ |
|---|---|
| InChI | InChI=1S/C50H92O4/c1-44(34-36-46-45(43-52)35-37-47-49(2,3)39-32-40-50(46,47)4)38-42-54-48(53)33-30-28-26-24-22-20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-23-25-27-29-31-41-51/h35,38,46-47,51-52H,5-34,36-37,39-43H2,1-4H3/b44-38+/t46-,47-,50+/m1/s1 |
| InChIKey | IBFCDVDWHOUQBD-VFNRQVFXSA-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 | EiJMfnFLKS1 |
|---|---|
| Name | 15-(OMEGA-HYDROXYTRICONTANOYL)-LABDA-7,13-DIENE-15,20-DIOL |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H92O4 |
| InChI | InChI=1S/C50H92O4/c1-44(34-36-46-45(43-52)35-37-47-49(2,3)39-32-40-50(46,47)4)38-42-54-48(53)33-30-28-26-24-22-20-18-16-14-12-10-8-6-5-7-9-11-13-15-17-19-21-23-25-27-29-31-41-51/h35,38,46-47,51-52H,5-34,36-37,39-43H2,1-4H3/b44-38+/t46-,47-,50+/m1/s1 |
| InChIKey | IBFCDVDWHOUQBD-VFNRQVFXSA-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 | UWCS22714 |