| SpectraBase Compound ID | LrafPMnF5gS |
|---|---|
| InChI | InChI=1S/C45H67N9O9/c1-27(2)12-7-6-8-16-39(57)50-36(23-29-17-19-31(56)20-18-29)41(59)54-38(26-55)43(61)52-35(22-28(3)4)40(58)53-37(24-30-25-49-33-14-10-9-13-32(30)33)42(60)51-34(44(62)63-5)15-11-21-48-45(46)47/h9-10,13-14,17-20,25,27-28,34-38,49,55-56H,6-8,11-12,15-16,21-24,26H2,1-5H3,(H,50,57)(H,51,60)(H,52,61)(H,53,58)(H,54,59)(H4,46,47,48)/t34-,35+,36-,37+,38-/m1/s1 |
| InChIKey | YCOJLQCEMMENET-LYBWPPJBSA-N |
| Mol Weight | 878.1 g/mol |
| Molecular Formula | C45H67N9O9 |
| Exact Mass | 877.506175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LHFOio6ipTW |
|---|---|
| Name | TAURAMAMIDE_METHYLESTER |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H67N9O9 |
| InChI | InChI=1S/C45H67N9O9/c1-27(2)12-7-6-8-16-39(57)50-36(23-29-17-19-31(56)20-18-29)41(59)54-38(26-55)43(61)52-35(22-28(3)4)40(58)53-37(24-30-25-49-33-14-10-9-13-32(30)33)42(60)51-34(44(62)63-5)15-11-21-48-45(46)47/h9-10,13-14,17-20,25,27-28,34-38,49,55-56H,6-8,11-12,15-16,21-24,26H2,1-5H3,(H,50,57)(H,51,60)(H,52,61)(H,53,58)(H,54,59)(H4,46,47,48)/t34-,35+,36-,37+,38-/m1/s1 |
| InChIKey | YCOJLQCEMMENET-LYBWPPJBSA-N |
| Literature Reference Author | K.DESJARDINE,A.PEREIRA,H.WRIGHT,T.MATAINAHO,M.KELLY,R.J.ANDE RSEN |
| Literature Reference Citation | J.NAT.PROD.,70,1850(2007) |
| Literature Reference DOI | 10.1021/np070209r |
| Molecular Weight | 878.082 g/mol |
| Sample ID | 31124 |
| Solvent | DMSO-D6 |