| SpectraBase Compound ID | ALz64R59Hpb |
|---|---|
| InChI | InChI=1S/C33H63N11O15/c34-7-1-4-14(35)10-18(46)42-8-2-5-15(36)11-19(47)43-9-3-6-16(37)12-20(48)56-28-27(58-32(40)53)25(52)24(51)26(29(28)59-33(41)54)57-30-23(50)21(44-31(38)39)22(49)17(13-45)55-30/h14-17,21-30,45,49-52H,1-13,34-37H2,(H2,40,53)(H2,41,54)(H,42,46)(H,43,47)(H4,38,39,44)/t14?,15?,16?,17-,21+,22-,23+,24-,25-,26+,27+,28+,29-,30-/m1/s1 |
| InChIKey | QRYFUMRKYLKPDH-QQHBIUQDSA-N |
| Mol Weight | 853.9 g/mol |
| Molecular Formula | C33H63N11O15 |
| Exact Mass | 853.45051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | q57ExmLjPj |
|---|---|
| Name | LL-BM-782-ALPHA-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H63N11O15 |
| InChI | InChI=1S/C33H63N11O15/c34-7-1-4-14(35)10-18(46)42-8-2-5-15(36)11-19(47)43-9-3-6-16(37)12-20(48)56-28-27(58-32(40)53)25(52)24(51)26(29(28)59-33(41)54)57-30-23(50)21(44-31(38)39)22(49)17(13-45)55-30/h14-17,21-30,45,49-52H,1-13,34-37H2,(H2,40,53)(H2,41,54)(H,42,46)(H,43,47)(H4,38,39,44)/t14?,15?,16?,17-,21+,22-,23+,24-,25-,26+,27+,28+,29-,30-/m1/s1 |
| InChIKey | QRYFUMRKYLKPDH-QQHBIUQDSA-N |
| Literature Reference Author | W.MCGAHREN,B.HARDY,G.MORTON,F.LOVELL,N.PERKINSON,R.HARGREAVE S,D.BORDERS |
| Literature Reference Citation | J.ORG.CHEM.,46,792(1981) |
| Literature Reference DOI | 10.1021/jo00317a029 |
| Molecular Weight | 853.928 g/mol |
| Solvent | D2O |
| Source File Reference | UNIW20198 |