| SpectraBase Compound ID | 94h43R0NUSs |
|---|---|
| InChI | InChI=1S/C27H38O13/c1-11(2)9-27(37)23(36)25(3,4)22(35)26(5,6)24(27)40-21-19(33)18(32)17(31)15(39-21)10-38-20(34)12-7-13(28)16(30)14(29)8-12/h7-8,11,15,17-19,21,24,28-33,37H,9-10H2,1-6H3/t15-,17-,18+,19-,21+,24-,27-/m0/s1 |
| InChIKey | WCCHBRULTMYRJM-ZMARRGOUSA-N |
| Mol Weight | 570.6 g/mol |
| Molecular Formula | C27H38O13 |
| Exact Mass | 570.231241 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Y7H3Ej1KzZ |
|---|---|
| Name | GALLOMYRTUCOMMULONE_A |
| Compound Number | 3A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H38O13 |
| InChI | InChI=1S/C27H38O13/c1-11(2)9-27(37)23(36)25(3,4)22(35)26(5,6)24(27)40-21-19(33)18(32)17(31)15(39-21)10-38-20(34)12-7-13(28)16(30)14(29)8-12/h7-8,11,15,17-19,21,24,28-33,37H,9-10H2,1-6H3/t15-,17-,18+,19-,21+,24-,27-/m0/s1 |
| InChIKey | WCCHBRULTMYRJM-ZMARRGOUSA-N |
| Literature Reference Author | G.APPENDINO,L.MAXIA,P.BETTONI,M.LOCATELLI,C.VALDIVIA,M.BALLE RO,M.STAVRI,S.GIBBON |
| Literature Reference Citation | J.NAT.PROD.,69,251(2006) |
| Literature Reference DOI | 10.1021/np050462w |
| Molecular Weight | 570.591 g/mol |
| Solvent | CD3OD:CDCl3=1:10 |
| Source File Reference | UWMZ16998 |