| SpectraBase Compound ID | 30LnCCOzQo |
|---|---|
| InChI | InChI=1S/C28H43NO6/c1-7-16(2)12-17(3)13-19(5)26-18(4)8-9-22(35-26)24-25(32)21(15-29(6)27(24)33)28(34)11-10-20(30)14-23(28)31/h13,15-18,22-23,26,31-32,34H,7-12,14H2,1-6H3/b19-13+/t16?,17?,18-,22-,23+,26-,28+/m1/s1 |
| InChIKey | CYNJYGDSSURTLH-QVITWHIESA-N |
| Mol Weight | 489.7 g/mol |
| Molecular Formula | C28H43NO6 |
| Exact Mass | 489.309038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9BdZX5KGmAC |
|---|---|
| Name | (-)-OXYSPORIDINONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H43NO6 |
| InChI | InChI=1S/C28H43NO6/c1-7-16(2)12-17(3)13-19(5)26-18(4)8-9-22(35-26)24-25(32)21(15-29(6)27(24)33)28(34)11-10-20(30)14-23(28)31/h13,15-18,22-23,26,31-32,34H,7-12,14H2,1-6H3/b19-13+/t16?,17?,18-,22-,23+,26-,28+/m1/s1 |
| InChIKey | CYNJYGDSSURTLH-QVITWHIESA-N |
| Literature Reference Author | J.ZHAN,A.M.BURNS,M.X.LIU,S.H.FAETH,A.A.L.GUNATILAKA |
| Literature Reference Citation | J.NAT.PROD.,70,227(2007) |
| Literature Reference DOI | 10.1021/np060394t |
| Molecular Weight | 489.653 g/mol |
| Sample ID | 29629 |
| Solvent | CD3OD |