| SpectraBase Compound ID | 4GSZk3hlvdV |
|---|---|
| InChI | InChI=1S/C28H40O3/c1-16(2)17(3)7-8-18(4)21-15-25-28(31-25)22-14-24(30)23-13-19(29)9-11-26(23,5)20(22)10-12-27(21,28)6/h7-8,14,16-18,20-21,23,25H,9-13,15H2,1-6H3/b8-7+/t17-,18+,20-,21+,23-,25+,26+,27+,28+/m0/s1 |
| InChIKey | NMGBSMCZPMYTKL-DBRZCXIFSA-N |
| Mol Weight | 424.6 g/mol |
| Molecular Formula | C28H40O3 |
| Exact Mass | 424.297745 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J2KhGH92IsH |
|---|---|
| Name | GYMNASTERONE_B |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H40O3 |
| InChI | InChI=1S/C28H40O3/c1-16(2)17(3)7-8-18(4)21-15-25-28(31-25)22-14-24(30)23-13-19(29)9-11-26(23,5)20(22)10-12-27(21,28)6/h7-8,14,16-18,20-21,23,25H,9-13,15H2,1-6H3/b8-7+/t17-,18+,20-,21+,23-,25+,26+,27+,28+/m0/s1 |
| InChIKey | NMGBSMCZPMYTKL-DBRZCXIFSA-N |
| Literature Reference Author | T.AMAGATA,M.TANAKA,T.YAMADA,M.DOI,K.MINOURA,H.OHISHI,T.YAMOR I,A.NUMATA |
| Literature Reference Citation | J.NAT.PROD.,70,1731(2007) |
| Literature Reference DOI | 10.1021/np070165m |
| Molecular Weight | 424.624 g/mol |
| Sample ID | 31021 |
| Solvent | CDCl3 |