| SpectraBase Compound ID | 7MgZCSTpduG |
|---|---|
| InChI | InChI=1S/C36H43BrN4O7/c1-19-13-20(2)15-22(4)48-32(44)18-28(24-11-12-30(42)31(43)16-24)40-35(46)29(17-26-25-9-7-8-10-27(25)39-33(26)37)41(6)36(47)23(5)38-34(45)21(3)14-19/h7-13,16,18,20-23,29,39,42-43H,14-15,17H2,1-6H3,(H,38,45)(H,40,46)/b19-13+,28-18-/t20-,21-,22-,23-,29+/m0/s1 |
| InChIKey | QIXWTNQUYUZIHF-HOYRBNAJSA-N |
| Mol Weight | 723.7 g/mol |
| Molecular Formula | C36H43BrN4O7 |
| Exact Mass | 722.231513 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Hk2jVsDqSx |
|---|---|
| Name | (+)-JASPLAKINOLIDE_W |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H43BrN4O7 |
| InChI | InChI=1S/C36H43BrN4O7/c1-19-13-20(2)15-22(4)48-32(44)18-28(24-11-12-30(42)31(43)16-24)40-35(46)29(17-26-25-9-7-8-10-27(25)39-33(26)37)41(6)36(47)23(5)38-34(45)21(3)14-19/h7-13,16,18,20-23,29,39,42-43H,14-15,17H2,1-6H3,(H,38,45)(H,40,46)/b19-13+,28-18-/t20-,21-,22-,23-,29+/m0/s1 |
| InChIKey | QIXWTNQUYUZIHF-HOYRBNAJSA-N |
| Literature Reference Author | K.R.WATTS,B.I.MORINAKA,T.AMAGATA,S.J.ROBINSON,K.TENNEY,W.M.B RAY,N.C.GASSNER,R.S. |
| Literature Reference Citation | J.NAT.PROD.,74,341(2011) |
| Literature Reference DOI | 10.1021/np100721g |
| Molecular Weight | 723.664 g/mol |
| Sample ID | 37443 |
| Solvent | CD3OD |