| SpectraBase Compound ID | 5YybYpyblSa |
|---|---|
| InChI | InChI=1S/C28H36O9/c1-15-13-21(33-16(2)29)24(35-18(4)31)27(7)22(36-25(32)19-11-9-8-10-12-19)14-20-23(34-17(3)30)28(15,27)37-26(20,5)6/h8-12,15,20-24H,13-14H2,1-7H3/t15-,20-,21+,22+,23-,24+,27-,28-/m1/s1 |
| InChIKey | BGJHHQRHKDDKIR-OKPVOZINSA-N |
| Mol Weight | 516.6 g/mol |
| Molecular Formula | C28H36O9 |
| Exact Mass | 516.235933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F46h8VQ9ZVb |
|---|---|
| Name | TRIPTOGELIN-C-1 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H36O9 |
| InChI | InChI=1S/C28H36O9/c1-15-13-21(33-16(2)29)24(35-18(4)31)27(7)22(36-25(32)19-11-9-8-10-12-19)14-20-23(34-17(3)30)28(15,27)37-26(20,5)6/h8-12,15,20-24H,13-14H2,1-7H3/t15-,20-,21+,22+,23-,24+,27-,28-/m1/s1 |
| InChIKey | BGJHHQRHKDDKIR-OKPVOZINSA-N |
| Literature Reference Author | Y.TAKAISHI,K.TOKURA,S.TAMAI,K.UJITA,K.NAKANO,T.TOMIMATSU |
| Literature Reference Citation | PHYTOCHEM.,30,1567(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84210-J |
| Molecular Weight | 516.588 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS26071 |