| SpectraBase Compound ID | CxCjhMRi7hE |
|---|---|
| InChI | InChI=1S/C40H57N5O10/c1-10-30-37(49)44-34(40(53)54)26(7)36(48)43-33(22(2)3)38(50)41-28(25(6)35(47)42-29(39(51)52)18-19-32(46)45(30)8)17-16-23(4)20-24(5)31(55-9)21-27-14-12-11-13-15-27/h10-17,20,22,24-26,28-29,31,33-34H,18-19,21H2,1-9H3,(H,41,50)(H,42,47)(H,43,48)(H,44,49)(H,51,52)(H,53,54)/b17-16+,23-20+,30-10-/t24-,25+,26-,28-,29+,31-,33-,34+/m0/s1 |
| InChIKey | GIRIHYQVGVTBIP-DIPAWVGWSA-N |
| Mol Weight | 767.9 g/mol |
| Molecular Formula | C40H57N5O10 |
| Exact Mass | 767.410543 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fx5rMtfb56R |
|---|---|
| Name | ISOMOTUPORIN |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H57N5O10 |
| InChI | InChI=1S/C40H57N5O10/c1-10-30-37(49)44-34(40(53)54)26(7)36(48)43-33(22(2)3)38(50)41-28(25(6)35(47)42-29(39(51)52)18-19-32(46)45(30)8)17-16-23(4)20-24(5)31(55-9)21-27-14-12-11-13-15-27/h10-17,20,22,24-26,28-29,31,33-34H,18-19,21H2,1-9H3,(H,41,50)(H,42,47)(H,43,48)(H,44,49)(H,51,52)(H,53,54)/b17-16+,23-20+,30-10-/t24-,25+,26-,28-,29+,31-,33-,34+/m0/s1 |
| InChIKey | GIRIHYQVGVTBIP-DIPAWVGWSA-N |
| Literature Reference Author | C.J.WEGERSKI,J.HAMMOND,K.TENNEY,T.MATAINAHO,P.CREWS |
| Literature Reference Citation | J.NAT.PROD.,70,89(2007) |
| Literature Reference DOI | 10.1021/np060464w |
| Molecular Weight | 767.920 g/mol |
| Sample ID | 29519 |
| Solvent | CD3OD |