| SpectraBase Compound ID | 1SGEv2RRQE |
|---|---|
| InChI | InChI=1S/C40H52O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-20,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,29-15-,30-16+,31-19+,32-20- |
| InChIKey | DVICWXUADSCSLL-LABBHJDPSA-N |
| Mol Weight | 564.9 g/mol |
| Molecular Formula | C40H52O2 |
| Exact Mass | 564.396731 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HM8E6AVL8pM |
|---|---|
| Name | Alloxanthin |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C40H52O2 |
| InChI | InChI=1S/C40H52O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-20,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,29-15-,30-16+,31-19+,32-20- |
| InChIKey | DVICWXUADSCSLL-LABBHJDPSA-N |
| Literature Reference | A. Khare, G.P. Moss, B.C. Weedon, J. Chem. Soc. Perkin I 1389 (1988). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |