| SpectraBase Compound ID | 5hWStC29lJd |
|---|---|
| InChI | InChI=1S/C31H37NO8/c1-6-17-7-8-19(33)16(3)39-26(36)27(4)20-14-21(34)32-30(20)25(35)18-13-15(2)24(38-5)23-22(18)31(27,28(30)11-12-28)40-29(23,37)10-9-17/h7-8,13,16-17,19-20,33,37H,6,9-12,14H2,1-5H3,(H,32,34)/b8-7+/t16-,17?,19-,20?,27+,29?,30?,31?/m0/s1 |
| InChIKey | PVLMJGLSEDPFOO-OYJVDZILSA-N |
| Mol Weight | 551.6 g/mol |
| Molecular Formula | C31H37NO8 |
| Exact Mass | 551.251917 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EbkPRgmdFIU |
|---|---|
| Name | PVLMJGLSEDPFOO-OYJVDZILSA-N |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H37NO8 |
| InChI | InChI=1S/C31H37NO8/c1-6-17-7-8-19(33)16(3)39-26(36)27(4)20-14-21(34)32-30(20)25(35)18-13-15(2)24(38-5)23-22(18)31(27,28(30)11-12-28)40-29(23,37)10-9-17/h7-8,13,16-17,19-20,33,37H,6,9-12,14H2,1-5H3,(H,32,34)/b8-7+/t16-,17?,19-,20?,27+,29?,30?,31?/m0/s1 |
| InChIKey | PVLMJGLSEDPFOO-OYJVDZILSA-N |
| Literature Reference Author | P.CAI,F.KONG,M.E.RUPPEN,G.GLASIER,G.T.CARTER |
| Literature Reference Citation | J.NAT.PROD.,68,1736(2005) |
| Literature Reference DOI | 10.1021/np050272l |
| Molecular Weight | 551.637 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ13147 |