| SpectraBase Compound ID | 4YDObJFas5A |
|---|---|
| InChI | InChI=1S/C31H57NO7/c32-26(24-33)25-37-23-17-13-9-7-5-3-1-2-4-6-8-12-16-21-31-22-20-27(34)30(39-31)28(38-31)18-14-10-11-15-19-29(35)36/h15,19,26-28,30,33-34H,1-14,16-18,20-25,32H2,(H,35,36)/b19-15+/t26?,27-,28-,30-,31+/m1/s1 |
| InChIKey | MGDKOMQHCUNZHH-ARLUSXIZSA-N |
| Mol Weight | 555.8 g/mol |
| Molecular Formula | C31H57NO7 |
| Exact Mass | 555.413503 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JC2zTb2FUbN |
|---|---|
| Name | DIDEMNISERINOLIPID-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H57NO7 |
| InChI | InChI=1S/C31H57NO7/c32-26(24-33)25-37-23-17-13-9-7-5-3-1-2-4-6-8-12-16-21-31-22-20-27(34)30(39-31)28(38-31)18-14-10-11-15-19-29(35)36/h15,19,26-28,30,33-34H,1-14,16-18,20-25,32H2,(H,35,36)/b19-15+/t26?,27-,28-,30-,31+/m1/s1 |
| InChIKey | MGDKOMQHCUNZHH-ARLUSXIZSA-N |
| Literature Reference Author | N.GONZALES,J.RODRIGUEZ,C.JIMENEZ |
| Literature Reference Citation | J.ORG.CHEM.,64,5705(1999) |
| Literature Reference DOI | 10.1021/jo9903914 |
| Molecular Weight | 555.796 g/mol |
| Sample ID | 40164 |
| Solvent | CDCl3 |