| SpectraBase Compound ID | 5PLZLc47K66 |
|---|---|
| InChI | InChI=1S/C30H56N12O5/c31-9-14-36-26(43)5-19-41(20-6-27(44)37-15-10-32)18-2-4-25(30(47)40-24-3-1-13-35-23-24)42(21-7-28(45)38-16-11-33)22-8-29(46)39-17-12-34/h1,3,13,23,25H,2,4-12,14-22,31-34H2,(H,36,43)(H,37,44)(H,38,45)(H,39,46)(H,40,47)/t25-/m0/s1 |
| InChIKey | UQHVFINBKUIKRT-VWLOTQADSA-N |
| Mol Weight | 664.9 g/mol |
| Molecular Formula | C30H56N12O5 |
| Exact Mass | 664.449663 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqzWkHdeiqF |
|---|---|
| Name | UQHVFINBKUIKRT-VWLOTQADSA-N |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H56N12O5 |
| InChI | InChI=1S/C30H56N12O5/c31-9-14-36-26(43)5-19-41(20-6-27(44)37-15-10-32)18-2-4-25(30(47)40-24-3-1-13-35-23-24)42(21-7-28(45)38-16-11-33)22-8-29(46)39-17-12-34/h1,3,13,23,25H,2,4-12,14-22,31-34H2,(H,36,43)(H,37,44)(H,38,45)(H,39,46)(H,40,47)/t25-/m0/s1 |
| InChIKey | UQHVFINBKUIKRT-VWLOTQADSA-N |
| Literature Reference Author | P.POLCYN,P.IELINSKA,M.ZIMNICKA,A.TROC,P.KALICKI,J.SOLECKA,A. LASKOWSKA |
| Literature Reference Citation | MOLECULES,18,7120(2013) |
| Literature Reference DOI | 10.3390/molecules18067120 |
| Molecular Weight | 664.852 g/mol |
| Solvent | Unknown |
| Source File Reference | UWBT9479 |