![N-[[2-(LACTOBIONAMIDO)-ETHYL]-N-[2-[2,3-(DITETRADECANAMIDO)-PROPIONAMIDO]-ETHYL]]-LACTOBIONAMIDE;BISLAC](/api/spectrum/1x7XSri8KRJ/structure.png?h=300&w=458 "N-[[2-(LACTOBIONAMIDO)-ETHYL]-N-[2-[2,3-(DITETRADECANAMIDO)-PROPIONAMIDO]-ETHYL]]-LACTOBIONAMIDE;BISLAC")
| SpectraBase Compound ID | E0BuneQwtsh |
|---|---|
| InChI | InChI=1S/C61H116N6O25/c1-3-5-7-9-11-13-15-17-19-21-23-25-43(74)65-33-38(66-44(75)26-24-22-20-18-16-14-12-10-8-6-4-2)57(86)62-27-30-67(31-28-63-58(87)51(82)49(80)55(39(72)34-68)91-60-53(84)47(78)45(76)41(36-70)89-60)32-29-64-59(88)52(83)50(81)56(40(73)35-69)92-61-54(85)48(79)46(77)42(37-71)90-61/h38-42,45-56,60-61,68-73,76-85H,3-37H2,1-2H3,(H,62,86)(H,63,87)(H,64,88)(H,65,74)(H,66,75)/t38?,39?,40?,41-,42-,45+,46+,47+,48+,49?,50?,51?,52?,53-,54-,55?,56?,60+,61+/m0/s1 |
| InChIKey | RMDCZJIDKXDQMB-SKMNOAOXSA-N |
| Mol Weight | 1333.6 g/mol |
| Molecular Formula | C61H116N6O25 |
| Exact Mass | 1332.799013 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1x7XSri8KRJ |
|---|---|
| Name | N-[[2-(LACTOBIONAMIDO)-ETHYL]-N-[2-[2,3-(DITETRADECANAMIDO)-PROPIONAMIDO]-ETHYL]]-LACTOBIONAMIDE;BISLAC |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H116N6O25 |
| InChI | InChI=1S/C61H116N6O25/c1-3-5-7-9-11-13-15-17-19-21-23-25-43(74)65-33-38(66-44(75)26-24-22-20-18-16-14-12-10-8-6-4-2)57(86)62-27-30-67(31-28-63-58(87)51(82)49(80)55(39(72)34-68)91-60-53(84)47(78)45(76)41(36-70)89-60)32-29-64-59(88)52(83)50(81)56(40(73)35-69)92-61-54(85)48(79)46(77)42(37-71)90-61/h38-42,45-56,60-61,68-73,76-85H,3-37H2,1-2H3,(H,62,86)(H,63,87)(H,64,88)(H,65,74)(H,66,75)/t38?,39?,40?,41-,42-,45+,46+,47+,48+,49?,50?,51?,52?,53-,54-,55?,56?,60+,61+/m0/s1 |
| InChIKey | RMDCZJIDKXDQMB-SKMNOAOXSA-N |
| Literature Reference Author | B.FAROUX-CORLAY,J.GREINER,R.TERREUX,D.CABROL-BASS,A.M.AUBERT IN,P.VIERLING,J.FANT |
| Literature Reference Citation | J.MED.CHEM.,44,2188(2001) |
| Literature Reference DOI | 10.1021/jm0011124 |
| Molecular Weight | 1333.617 g/mol |
| Sample ID | 44599 |
| Solvent | CDCl3:CD3OD |