| SpectraBase Compound ID | EhuZycmqXap |
|---|---|
| InChI | InChI=1S/C20H32O5/c1-13(7-10-21)5-6-15-14(12-22)11-16(23)17-19(15,2)8-4-9-20(17,3)18(24)25/h7,11,15-17,21-23H,4-6,8-10,12H2,1-3H3,(H,24,25)/b13-7+/t15-,16+,17?,19+,20-/m0/s1 |
| InChIKey | PUHWMICUIXKFCL-ZGPOGJEFSA-N |
| Mol Weight | 352.5 g/mol |
| Molecular Formula | C20H32O5 |
| Exact Mass | 352.224974 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EuqR5cPRRYX |
|---|---|
| Name | LABDA-7,13-(E)-DIENE-6-BETA,15,17-TRIOL-19-OIC_ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H32O5 |
| InChI | InChI=1S/C20H32O5/c1-13(7-10-21)5-6-15-14(12-22)11-16(23)17-19(15,2)8-4-9-20(17,3)18(24)25/h7,11,15-17,21-23H,4-6,8-10,12H2,1-3H3,(H,24,25)/b13-7+/t15-,16+,17?,19+,20-/m0/s1 |
| InChIKey | PUHWMICUIXKFCL-ZGPOGJEFSA-N |
| Literature Reference Author | S.J.LIN,J.P.N.ROSAZZA |
| Literature Reference Citation | J.NAT.PROD.,61,922(1998) |
| Literature Reference DOI | 10.1021/np980064b |
| Molecular Weight | 352.471 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ1131 |