| SpectraBase Compound ID | Lm9HI7kel4p |
|---|---|
| InChI | InChI=1S/C38H66N4O25/c1-11-24(53)30(59)34(67-36-22(41-14(4)50)29(58)27(56)19(9-46)62-36)38(60-11)66-33-23(42-15(5)51)37(64-31(25(54)17(52)7-44)16(6-43)39-12(2)48)63-20(10-47)32(33)65-35-21(40-13(3)49)28(57)26(55)18(8-45)61-35/h11,16-38,43-47,52-59H,6-10H2,1-5H3,(H,39,48)(H,40,49)(H,41,50)(H,42,51)/t11-,16+,17+,18+,19-,20+,21+,22-,23+,24+,25-,26-,27+,28+,29-,30+,31+,32+,33+,34-,35-,36-,37-,38-/m1/s1 |
| InChIKey | SBWVKIQIIRVDFC-QYAFFHNDSA-N |
| Mol Weight | 978.9 g/mol |
| Molecular Formula | C38H66N4O25 |
| Exact Mass | 978.401614 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6F886ImSHDJ |
|---|---|
| Name | HPG-BETA-(2)-N-5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H66N4O25 |
| InChI | InChI=1S/C38H66N4O25/c1-11-24(53)30(59)34(67-36-22(41-14(4)50)29(58)27(56)19(9-46)62-36)38(60-11)66-33-23(42-15(5)51)37(64-31(25(54)17(52)7-44)16(6-43)39-12(2)48)63-20(10-47)32(33)65-35-21(40-13(3)49)28(57)26(55)18(8-45)61-35/h11,16-38,43-47,52-59H,6-10H2,1-5H3,(H,39,48)(H,40,49)(H,41,50)(H,42,51)/t11-,16+,17+,18+,19-,20+,21+,22-,23+,24+,25-,26-,27+,28+,29-,30+,31+,32+,33+,34-,35-,36-,37-,38-/m1/s1 |
| InChIKey | SBWVKIQIIRVDFC-QYAFFHNDSA-N |
| Literature Reference Author | Y.KATO,M.OHTA,T.MUNAKATA,M.FUJIWARA,N.FUJII,S.SHIGETA,F.MATS UURA |
| Literature Reference Citation | MAGN.RES.CHEM.,39,259(2001) |
| Literature Reference DOI | 10.1002/mrc.842 |
| Molecular Weight | 978.954 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI24901 |