| SpectraBase Compound ID | 5ZLVQiYHn3W |
|---|---|
| InChI | InChI=1S/C25H29ClO8/c1-6-14(2)9-15(3)7-8-17-12-18-21(26)22(30)24(5,23(31)25(18,32)13-33-17)34-20(29)11-16(4)10-19(27)28/h7-9,11-12,14,32H,6,10,13H2,1-5H3,(H,27,28)/b8-7+,15-9+,16-11+ |
| InChIKey | VMNQERFVALEMDE-BZHKTWOISA-N |
| Mol Weight | 492.95 g/mol |
| Molecular Formula | C25H29ClO8 |
| Exact Mass | 492.155096 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6kCBO0obn1u |
|---|---|
| Name | ISOCHROMOPHILONE-XI |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H29ClO8 |
| InChI | InChI=1S/C25H29ClO8/c1-6-14(2)9-15(3)7-8-17-12-18-21(26)22(30)24(5,23(31)25(18,32)13-33-17)34-20(29)11-16(4)10-19(27)28/h7-9,11-12,14,32H,6,10,13H2,1-5H3,(H,27,28)/b8-7+,15-9+,16-11+ |
| InChIKey | VMNQERFVALEMDE-BZHKTWOISA-N |
| Literature Reference Author | N.JANSEN,B.OHLENDORF,A.ERHARD,T.BRUHN,G.BRINGMANN,J.F.IMHOFF |
| Literature Reference Citation | MAR.DRUGS,11,800(2013) |
| Literature Reference DOI | 10.3390/md11030800 |
| Molecular Weight | 492.953 g/mol |
| Source File Reference | UWLU74786 |