| SpectraBase Compound ID | 7Q4LITR3Kob |
|---|---|
| InChI | InChI=1S/C29H52O8S.Na/c1-17(2)19(10-13-37-38(34,35)36)7-6-18(3)23-15-24(31)26-21-14-25(32)29(33)16-20(30)8-12-28(29,5)22(21)9-11-27(23,26)4;/h17-26,30-33H,6-16H2,1-5H3,(H,34,35,36);/q;+1/p-1/t18-,19+,20+,21?,22?,23-,24+,25-,26?,27-,28-,29+;/m1./s1 |
| InChIKey | QHZQFDJPNLXZRK-XJEQAFKRSA-M |
| Mol Weight | 582.8 g/mol |
| Molecular Formula | C29H51NaO8S |
| Exact Mass | 582.320234 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ECWaa05Opml |
|---|---|
| Name | QHZQFDJPNLXZRK-XJEQAFKRSA-M |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H51NaO8S |
| InChI | InChI=1S/C29H52O8S.Na/c1-17(2)19(10-13-37-38(34,35)36)7-6-18(3)23-15-24(31)26-21-14-25(32)29(33)16-20(30)8-12-28(29,5)22(21)9-11-27(23,26)4;/h17-26,30-33H,6-16H2,1-5H3,(H,34,35,36);/q;+1/p-1/t18-,19+,20+,21?,22?,23-,24+,25-,26?,27-,28-,29+;/m1./s1 |
| InChIKey | QHZQFDJPNLXZRK-XJEQAFKRSA-M |
| Literature Reference Author | M.IORIZZI,P.BRYAN,J.MCCLINTOCK,L.MINALE,E.PALAGIANO,S.MAUREL LI,R.RICCIO,F.ZOLLO |
| Literature Reference Citation | J.NAT.PROD.,58,653(1995) |
| Literature Reference DOI | 10.1021/np50119a003 |
| Molecular Weight | 582.769 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVP4474 |