| SpectraBase Compound ID | BlIdpEFP11x |
|---|---|
| InChI | InChI=1S/2C22H36N2O3/c2*1-3-4-5-12-21(27)23-13-8-15-24-14-7-10-18(24)16-20(26)22-17(2)9-6-11-19(22)25/h2*6,11,17-18,22H,3-5,7-10,12-16H2,1-2H3,(H,23,27)/p+2/t17-,18+,22+;17-,18-,22+/m11/s1 |
| InChIKey | MRCFXBZGUQUBRG-KLDQRZGCSA-P |
| Mol Weight | 755.1 g/mol |
| Molecular Formula | C44H74N4O6 |
| Exact Mass | 754.560836 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8wv8hCQyuBe |
|---|---|
| Name | PERIPENTONINE_A |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H74N4O6 |
| InChI | InChI=1S/2C22H36N2O3/c2*1-3-4-5-12-21(27)23-13-8-15-24-14-7-10-18(24)16-20(26)22-17(2)9-6-11-19(22)25/h2*6,11,17-18,22H,3-5,7-10,12-16H2,1-2H3,(H,23,27)/p+2/t17-,18+,22+;17-,18-,22+/m11/s1 |
| InChIKey | MRCFXBZGUQUBRG-KLDQRZGCSA-P |
| Literature Reference Author | P.L.KATAVIC,D.A.VENABLES,G.P.GUYMER,P.I.FORSTER,A.R.CARROLL |
| Literature Reference Citation | J.NAT.PROD.,70,1946(2007) |
| Literature Reference DOI | 10.1021/np070516x |
| Molecular Weight | 755.095 g/mol |
| Sample ID | 31200 |
| Solvent | CD3CN |