| SpectraBase Compound ID | IuWCkD5iqXM |
|---|---|
| InChI | InChI=1S/C27H36O6/c1-6-17(2)8-7-9-18(3)10-13-25(30)33-24-12-11-21(26(31)32)27(5)15-20(19(4)16-28)23(29)14-22(24)27/h9-10,13-14,16-17,20-21,24H,4,6-8,11-12,15H2,1-3,5H3,(H,31,32)/b13-10+,18-9+/t17?,20-,21+,24+,27+/m0/s1 |
| InChIKey | DXPNTMBJXVSKRN-GMUBOKCNSA-N |
| Mol Weight | 456.6 g/mol |
| Molecular Formula | C27H36O6 |
| Exact Mass | 456.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LHp9WHEkh4D |
|---|---|
| Name | DXPNTMBJXVSKRN-GMUBOKCNSA-N |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H36O6 |
| InChI | InChI=1S/C27H36O6/c1-6-17(2)8-7-9-18(3)10-13-25(30)33-24-12-11-21(26(31)32)27(5)15-20(19(4)16-28)23(29)14-22(24)27/h9-10,13-14,16-17,20-21,24H,4,6-8,11-12,15H2,1-3,5H3,(H,31,32)/b13-10+,18-9+/t17?,20-,21+,24+,27+/m0/s1 |
| InChIKey | DXPNTMBJXVSKRN-GMUBOKCNSA-N |
| Literature Reference Author | Y.SONG,J.WANG,H.HUANG,L.MA,J.WANG,Y.GU,L.LIU,Y.LIN |
| Literature Reference Citation | MAR.DRUGS,10,340(2012) |
| Literature Reference DOI | 10.3390/md10020340 |
| Molecular Weight | 456.579 g/mol |
| Source File Reference | UWIR5623 |