| SpectraBase Compound ID | LAGxv1QDMBz |
|---|---|
| InChI | InChI=1S/C31H50O2/c1-19(2)20(3)10-11-21(4)24-18-27(33)31(9)23-12-13-25-28(5,6)26(32)15-16-29(25,7)22(23)14-17-30(24,31)8/h12,14,19,21,24-27,32-33H,3,10-11,13,15-18H2,1-2,4-9H3/t21?,24-,25+,26+,27+,29-,30-,31-/m1/s1 |
| InChIKey | MJRURUDEESYVHI-RZRNWKEFSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C31H50O2 |
| Exact Mass | 454.381081 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5nlCQS1Q4cp |
|---|---|
| Name | SUBEROSOL |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H50O2 |
| InChI | InChI=1S/C31H50O2/c1-19(2)20(3)10-11-21(4)24-18-27(33)31(9)23-12-13-25-28(5,6)26(32)15-16-29(25,7)22(23)14-17-30(24,31)8/h12,14,19,21,24-27,32-33H,3,10-11,13,15-18H2,1-2,4-9H3/t21?,24-,25+,26+,27+,29-,30-,31-/m1/s1 |
| InChIKey | MJRURUDEESYVHI-RZRNWKEFSA-N |
| Literature Reference Author | H.Y.LI,N.J.SUN,Y.KASHIWADA,L.SUN,J.V.SNIDER,L.M.COSENTINO,K. H.LEE |
| Literature Reference Citation | J.NAT.PROD.,56,1130(1993) |
| Literature Reference DOI | 10.1021/np50097a017 |
| Molecular Weight | 454.737 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWTS237 |