| SpectraBase Compound ID | FN8zN50OcNI |
|---|---|
| InChI | InChI=1S/C41H63ClO8/c1-23(2)28-20-31(43)26(5)12-10-11-24(3)18-32(44)29-19-27(6)37-30(41(29,22-33(28)45)38(47)49-9)17-25(4)13-14-36-40(8,50-36)16-15-35(42)39(7,48)21-34(37)46/h17,23-24,26,28-30,34-36,46,48H,10-16,18-22H2,1-9H3/b25-17+/t24-,26+,28-,29+,30-,34-,35+,36-,39-,40-,41+/m1/s1 |
| InChIKey | JLHAOQMKTFIUTM-YXCJBUJZSA-N |
| Mol Weight | 719.4 g/mol |
| Molecular Formula | C41H63ClO8 |
| Exact Mass | 718.421147 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BCggJAGkLe4 |
|---|---|
| Name | XIMAOLIDE_B |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H63ClO8 |
| InChI | InChI=1S/C41H63ClO8/c1-23(2)28-20-31(43)26(5)12-10-11-24(3)18-32(44)29-19-27(6)37-30(41(29,22-33(28)45)38(47)49-9)17-25(4)13-14-36-40(8,50-36)16-15-35(42)39(7,48)21-34(37)46/h17,23-24,26,28-30,34-36,46,48H,10-16,18-22H2,1-9H3/b25-17+/t24-,26+,28-,29+,30-,34-,35+,36-,39-,40-,41+/m1/s1 |
| InChIKey | JLHAOQMKTFIUTM-YXCJBUJZSA-N |
| Literature Reference Author | R.JIA,Y.W.GUO,P.CHEN,Y.M.FANG,E.MOLLO,M.GAVAGNIN,G.CIMINO |
| Literature Reference Citation | J.NAT.PROD.,70,1158(2007) |
| Literature Reference DOI | 10.1021/np060220b |
| Molecular Weight | 719.399 g/mol |
| Sample ID | 30627 |
| Solvent | CDCl3 |