| SpectraBase Compound ID | 2pRZxCUOzQP |
|---|---|
| InChI | InChI=1S/C38H51BrN4O7/c1-8-50-34(46)20-32(27-13-15-28(45)16-14-27)42-37(48)33(19-30-29-11-9-10-12-31(29)41-35(30)39)43(7)38(49)26(6)40-36(47)24(4)18-22(2)17-23(3)25(5)21-44/h9-17,23-26,32-33,41,44-45H,8,18-21H2,1-7H3,(H,40,47)(H,42,48)/b22-17+/t23-,24-,25-,26-,32-,33+/m0/s1 |
| InChIKey | YKRVBJHUHDIHJV-KNKGTBGDSA-N |
| Mol Weight | 755.8 g/mol |
| Molecular Formula | C38H51BrN4O7 |
| Exact Mass | 754.294113 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7c3hKVSXVNO |
|---|---|
| Name | (+)-JASPLAKINOLIDE_Z_3 |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H51BrN4O7 |
| InChI | InChI=1S/C38H51BrN4O7/c1-8-50-34(46)20-32(27-13-15-28(45)16-14-27)42-37(48)33(19-30-29-11-9-10-12-31(29)41-35(30)39)43(7)38(49)26(6)40-36(47)24(4)18-22(2)17-23(3)25(5)21-44/h9-17,23-26,32-33,41,44-45H,8,18-21H2,1-7H3,(H,40,47)(H,42,48)/b22-17+/t23-,24-,25-,26-,32-,33+/m0/s1 |
| InChIKey | YKRVBJHUHDIHJV-KNKGTBGDSA-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 | 755.750 g/mol |
| Sample ID | 37440 |
| Solvent | CD3OD |