| SpectraBase Compound ID | 8c4MLBV3kMB |
|---|---|
| InChI | InChI=1S/C33H61NO7/c1-2-39-31(37)21-17-13-12-16-20-30-32-29(36)22-24-33(40-30,41-32)23-18-14-10-8-6-4-3-5-7-9-11-15-19-25-38-27-28(34)26-35/h17,21,28-30,32,35-36H,2-16,18-20,22-27,34H2,1H3/b21-17+/t28-,29-,30-,32+,33+/m1/s1 |
| InChIKey | SCVFGZQKCDPQKS-SUERPRGBSA-N |
| Mol Weight | 583.9 g/mol |
| Molecular Formula | C33H61NO7 |
| Exact Mass | 583.444803 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hvxixgApKN |
|---|---|
| Name | DIDEMNISERINOLIPID_B |
| Compound Number | NATURAL-1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H61NO7 |
| InChI | InChI=1S/C33H61NO7/c1-2-39-31(37)21-17-13-12-16-20-30-32-29(36)22-24-33(40-30,41-32)23-18-14-10-8-6-4-3-5-7-9-11-15-19-25-38-27-28(34)26-35/h17,21,28-30,32,35-36H,2-16,18-20,22-27,34H2,1H3/b21-17+/t28-,29-,30-,32+,33+/m1/s1 |
| InChIKey | SCVFGZQKCDPQKS-SUERPRGBSA-N |
| Literature Reference Author | H.KIYOTA,D.J.DIXON,C.K.LUSCOMBE,S.HETTSTEDT,S.V.LEY |
| Literature Reference Citation | ORG.LETTERS,4,3223(2002) |
| Literature Reference DOI | 10.1021/ol026421y |
| Molecular Weight | 583.850 g/mol |
| Solvent | Unknown |
| Source File Reference | UWMZ25720 |