![1-N-[3-AMINOPHENYLETHANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE](/api/spectrum/4U1TytlGRNT/structure.png?h=300&w=458 "1-N-[3-AMINOPHENYLETHANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE")
| SpectraBase Compound ID | K5303Vb2J7h |
|---|---|
| InChI | InChI=1S/C26H47N7O7/c27-6-1-2-7-32-8-9-38-25-17(33-19(34)11-14-4-3-5-15(29)10-14)12-16(30)24(23(25)37)40-26-20(31)22(36)21(35)18(13-28)39-26/h3-5,10,16-18,20-26,32,35-37H,1-2,6-9,11-13,27-31H2,(H,33,34)/t16-,17+,18+,20+,21+,22+,23-,24+,25-,26+/m0/s1 |
| InChIKey | MQQZQOWKEYULQI-ZHGZHUQRSA-N |
| Mol Weight | 569.7 g/mol |
| Molecular Formula | C26H47N7O7 |
| Exact Mass | 569.353697 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4U1TytlGRNT |
|---|---|
| Name | 1-N-[3-AMINOPHENYLETHANOYL]-6-O-[2-N-(4-BUTYLAMINO)-ETHYLAMINO]-NEAMINE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H47N7O7 |
| InChI | InChI=1S/C26H47N7O7/c27-6-1-2-7-32-8-9-38-25-17(33-19(34)11-14-4-3-5-15(29)10-14)12-16(30)24(23(25)37)40-26-20(31)22(36)21(35)18(13-28)39-26/h3-5,10,16-18,20-26,32,35-37H,1-2,6-9,11-13,27-31H2,(H,33,34)/t16-,17+,18+,20+,21+,22+,23-,24+,25-,26+/m0/s1 |
| InChIKey | MQQZQOWKEYULQI-ZHGZHUQRSA-N |
| Literature Reference Author | J.HADDAD,L.P.KOTRA,B.LLANO-SOTELO,C.KIM,E.F.AZUCENA,M.LIU,S. B.VAKULENKO,C.S.CHOW |
| Literature Reference Citation | J.AM.CHEM.SOC.,124,3229(2002) |
| Literature Reference DOI | 10.1021/ja011695m |
| Molecular Weight | 569.702 g/mol |
| Sample ID | 33658 |
| Solvent | D2O |