| SpectraBase Compound ID | JBOmupQt6T9 |
|---|---|
| InChI | InChI=1S/C43H74O20/c1-6-8-14-17-24-18-15-12-10-9-11-13-16-19-27(46)60-38-35(61-40-34(53)31(50)28(47)21(3)54-40)23(5)56-43(39(38)59-26(45)7-2)63-37-33(52)30(49)25(20-44)58-42(37)62-36-32(51)29(48)22(4)55-41(36)57-24/h21-25,28-44,47-53H,6-20H2,1-5H3/t21-,22-,23+,24+,25-,28-,29-,30-,31+,32+,33+,34-,35+,36-,37-,38-,39-,40+,41+,42+,43+/m1/s1 |
| InChIKey | PVATZCKYGRERLI-IUFOOCIMSA-N |
| Mol Weight | 911.0 g/mol |
| Molecular Formula | C43H74O20 |
| Exact Mass | 910.477345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FMyQkpdTcjd |
|---|---|
| Name | TYRIANTHIN_9 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H74O20 |
| InChI | InChI=1S/C43H74O20/c1-6-8-14-17-24-18-15-12-10-9-11-13-16-19-27(46)60-38-35(61-40-34(53)31(50)28(47)21(3)54-40)23(5)56-43(39(38)59-26(45)7-2)63-37-33(52)30(49)25(20-44)58-42(37)62-36-32(51)29(48)22(4)55-41(36)57-24/h21-25,28-44,47-53H,6-20H2,1-5H3/t21-,22-,23+,24+,25-,28-,29-,30-,31+,32+,33+,34-,35+,36-,37-,38-,39-,40+,41+,42+,43+/m1/s1 |
| InChIKey | PVATZCKYGRERLI-IUFOOCIMSA-N |
| Literature Reference Author | I.LEON-RIVERA,G.MIRON-LOPEZ,G.M.MOLINA-SALINAS,M.HERRERA-RUI Z,S.ESTRADA-SOTO,M.D |
| Literature Reference Citation | J.NAT.PROD.,71,1686(2008) |
| Literature Reference DOI | 10.1021/np800266a |
| Molecular Weight | 911.049 g/mol |
| Sample ID | 29121 |
| Solvent | CD3OD |