| SpectraBase Compound ID | 3UUTj3i44As |
|---|---|
| InChI | InChI=1S/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27+/m1/s1 |
| InChIKey | RCKCYCDBDYUIGM-OBZVFWKUSA-N |
| Mol Weight | 528.51 g/mol |
| Molecular Formula | C27H28O11 |
| Exact Mass | 528.163162 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3gQBarfwxt9 |
|---|---|
| Name | TREMULACIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H28O11 |
| InChI | InChI=1S/C27H28O11/c28-14-19-21(30)22(31)23(38-24(32)16-8-2-1-3-9-16)25(37-19)36-18-11-5-4-10-17(18)15-35-26(33)27(34)13-7-6-12-20(27)29/h1-5,7-11,13,19,21-23,25,28,30-31,34H,6,12,14-15H2/t19-,21-,22+,23-,25-,27+/m1/s1 |
| InChIKey | RCKCYCDBDYUIGM-OBZVFWKUSA-N |
| Literature Reference Author | F.FEISTEL,C.PAETZ,S.LORENZ,B.SCHNEIDER |
| Literature Reference Citation | MOLECULES,20,5566(2015) |
| Literature Reference DOI | 10.3390/molecules20045566 |
| Molecular Weight | 528.513 g/mol |
| Solvent | CD3CN |
| Source File Reference | UWPA3057 |