| SpectraBase Compound ID | 9uh5p0ow7M8 |
|---|---|
| InChI | InChI=1S/C30H51NO23/c1-8-15(38)18(41)19(42)27(48-8)52-25-21(44)26(47-3)50-13(7-34)22(25)51-28-20(43)24(17(40)12(6-33)49-28)54-30(29(45)46)4-10(36)14(31-9(2)35)23(53-30)16(39)11(37)5-32/h8,10-28,32-34,36-44H,4-7H2,1-3H3,(H,31,35)(H,45,46)/t8-,10-,11+,12-,13-,14+,15+,16+,17+,18+,19-,20-,21-,22-,23+,24+,25-,26-,27-,28+,30-/m0/s1 |
| InChIKey | AIXYSWQDAPNCOM-XOCARQJCSA-N |
| Mol Weight | 793.7 g/mol |
| Molecular Formula | C30H51NO23 |
| Exact Mass | 793.285187 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ee6tC8LvF9F |
|---|---|
| Name | AIXYSWQDAPNCOM-XOCARQJCSA-N |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H51NO23 |
| InChI | InChI=1S/C30H51NO23/c1-8-15(38)18(41)19(42)27(48-8)52-25-21(44)26(47-3)50-13(7-34)22(25)51-28-20(43)24(17(40)12(6-33)49-28)54-30(29(45)46)4-10(36)14(31-9(2)35)23(53-30)16(39)11(37)5-32/h8,10-28,32-34,36-44H,4-7H2,1-3H3,(H,31,35)(H,45,46)/t8-,10-,11+,12-,13-,14+,15+,16+,17+,18+,19-,20-,21-,22-,23+,24+,25-,26-,27-,28+,30-/m0/s1 |
| InChIKey | AIXYSWQDAPNCOM-XOCARQJCSA-N |
| Literature Reference Author | J.M.COTERON,K.SINGH,J.L.ASENSIO,M.DOMINGUEZ-DALDA,A.FERNANDE Z-MAYORALAS,J.JIMENE |
| Literature Reference Citation | J.ORG.CHEM.,60,1502(1995) |
| Literature Reference DOI | 10.1021/jo00111a008 |
| Molecular Weight | 793.728 g/mol |
| Solvent | D2O |
| Source File Reference | UWRU3364 |