| SpectraBase Compound ID | AcKOUw9aFPp |
|---|---|
| InChI | InChI=1S/C46H67N5O8/c1-11-36-26-31(4)27-39(53)48(7)25-19-18-20-32(5)42(54)47-40(30(2)3)44(56)49(8)37(28-34-21-14-12-15-22-34)43(55)51(10)41(33(6)52)45(57)50(9)38(46(58)59-36)29-35-23-16-13-17-24-35/h12-17,19,21-25,30-33,36-38,40-41,52H,11,18,20,26-29H2,1-10H3,(H,47,54)/b25-19+/t31?,32?,33?,36?,37-,38-,40-,41-/m0/s1 |
| InChIKey | LJNGIVUAMWQJIA-PCAKUXBBSA-N |
| Mol Weight | 818.1 g/mol |
| Molecular Formula | C46H67N5O8 |
| Exact Mass | 817.498964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D4X478BU9Y7 |
|---|---|
| Name | BOUILLONAMIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H67N5O8 |
| InChI | InChI=1S/C46H67N5O8/c1-11-36-26-31(4)27-39(53)48(7)25-19-18-20-32(5)42(54)47-40(30(2)3)44(56)49(8)37(28-34-21-14-12-15-22-34)43(55)51(10)41(33(6)52)45(57)50(9)38(46(58)59-36)29-35-23-16-13-17-24-35/h12-17,19,21-25,30-33,36-38,40-41,52H,11,18,20,26-29H2,1-10H3,(H,47,54)/b25-19+/t31?,32?,33?,36?,37-,38-,40-,41-/m0/s1 |
| InChIKey | LJNGIVUAMWQJIA-PCAKUXBBSA-N |
| Literature Reference Author | L.T.TAN,T.OKINO,W.H.GERWICK |
| Literature Reference Citation | MAR.DRUGS,11,3015(2013) |
| Literature Reference DOI | 10.3390/md11083015 |
| Molecular Weight | 818.067 g/mol |
| Source File Reference | UWLU74915 |