| SpectraBase Compound ID | 8ly7sTz532u |
|---|---|
| InChI | InChI=1S/C36H44O13/c1-10-17(2)27(40)47-30-32(5,6)25(24(28(41)43-9)45-18(3)37)34(8)21-11-13-33(7)22(15-23(39)46-26(33)20-12-14-44-16-20)35(21)31(49-35)36(30,29(34)42)48-19(4)38/h10,12,14,16,21-22,24-26,30-31H,11,13,15H2,1-9H3/b17-10+/t21-,22+,24?,25+,26+,30-,31+,33-,34-,35-,36+/m1/s1 |
| InChIKey | APBIEISWLCINPH-BSHVWGERSA-N |
| Mol Weight | 684.7 g/mol |
| Molecular Formula | C36H44O13 |
| Exact Mass | 684.278191 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J43RyL5IQKu |
|---|---|
| Name | HUMILINOLIDE-F |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H44O13 |
| InChI | InChI=1S/C36H44O13/c1-10-17(2)27(40)47-30-32(5,6)25(24(28(41)43-9)45-18(3)37)34(8)21-11-13-33(7)22(15-23(39)46-26(33)20-12-14-44-16-20)35(21)31(49-35)36(30,29(34)42)48-19(4)38/h10,12,14,16,21-22,24-26,30-31H,11,13,15H2,1-9H3/b17-10+/t21-,22+,24?,25+,26+,30-,31+,33-,34-,35-,36+/m1/s1 |
| InChIKey | APBIEISWLCINPH-BSHVWGERSA-N |
| Literature Reference Author | A.JIMENEZ,C.VALLRREAL,R.A.TOSCANO,M.COOK,J.T.ARNASON,R.BYE,R .MATA |
| Literature Reference Citation | PHYTOCHEM.,49,1981(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00364-1 |
| Molecular Weight | 684.738 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU807 |