![#4;N,N'-BIS-[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-ALPHA,ALPHA,ALPHA',ALPHA'-TETRAKIS-[[[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-AMINO]-CARBONYL]-4,4'-BIPH](/api/spectrum/INBdeu3tdqX/structure.png?h=300&w=458 "#4;N,N'-BIS-[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-ALPHA,ALPHA,ALPHA',ALPHA'-TETRAKIS-[[[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-AMINO]-CARBONYL]-4,4'-BIPH")
| SpectraBase Compound ID | eBSduOcSBf |
|---|---|
| InChI | InChI=1S/C46H72N6O24/c53-11-39(12-54,13-55)47-33(71)45(34(72)48-40(14-56,15-57)16-58,35(73)49-41(17-59,18-60)19-61)9-29-1-5-31(6-2-29)32-7-3-30(4-8-32)10-46(36(74)50-42(20-62,21-63)22-64,37(75)51-43(23-65,24-66)25-67)38(76)52-44(26-68,27-69)28-70/h1-8,53-70H,9-28H2,(H,47,71)(H,48,72)(H,49,73)(H,50,74)(H,51,75)(H,52,76) |
| InChIKey | BVAUYECELMKHKC-UHFFFAOYSA-N |
| Mol Weight | 1093.1 g/mol |
| Molecular Formula | C46H72N6O24 |
| Exact Mass | 1092.459797 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INBdeu3tdqX |
|---|---|
| Name | #4;N,N'-BIS-[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-ALPHA,ALPHA,ALPHA',ALPHA'-TETRAKIS-[[[2-HYDROXY-1,1-BIS-(HYDROXYMETHYL)-ETHYL]-AMINO]-CARBONYL]-4,4'-BIPH |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72N6O24 |
| InChI | InChI=1S/C46H72N6O24/c53-11-39(12-54,13-55)47-33(71)45(34(72)48-40(14-56,15-57)16-58,35(73)49-41(17-59,18-60)19-61)9-29-1-5-31(6-2-29)32-7-3-30(4-8-32)10-46(36(74)50-42(20-62,21-63)22-64,37(75)51-43(23-65,24-66)25-67)38(76)52-44(26-68,27-69)28-70/h1-8,53-70H,9-28H2,(H,47,71)(H,48,72)(H,49,73)(H,50,74)(H,51,75)(H,52,76) |
| InChIKey | BVAUYECELMKHKC-UHFFFAOYSA-N |
| Literature Reference Author | G.R.NEWKOME,X.LIN,C.YAXIONG,G.H.ESCAMILLA |
| Literature Reference Citation | J.ORG.CHEM.,58,3123(1993) |
| Literature Reference DOI | 10.1021/jo00063a036 |
| Molecular Weight | 1093.103 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRK4187 |