| SpectraBase Compound ID | 42CrT2QEOOO |
|---|---|
| InChI | InChI=1S/C22H24N10O2/c23-21-29-15-11(5-9-27-19(33)13-3-1-7-25-13)16-18(32-22(24)30-16)12(17(15)31-21)6-10-28-20(34)14-4-2-8-26-14/h1-4,7-8,25-26H,5-6,9-10H2,(H,27,33)(H,28,34)(H3,23,29,31)(H3,24,30,32) |
| InChIKey | YVWAUKGCFJBKLO-UHFFFAOYSA-N |
| Mol Weight | 460.5 g/mol |
| Molecular Formula | C22H24N10O2 |
| Exact Mass | 460.20837 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2kgFTP9nxGD |
|---|---|
| Name | YVWAUKGCFJBKLO-UHFFFAOYSA-N |
| Compound Number | 19 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H24N10O2 |
| InChI | InChI=1S/C22H24N10O2/c23-21-29-15-11(5-9-27-19(33)13-3-1-7-25-13)16-18(32-22(24)30-16)12(17(15)31-21)6-10-28-20(34)14-4-2-8-26-14/h1-4,7-8,25-26H,5-6,9-10H2,(H,27,33)(H,28,34)(H3,23,29,31)(H3,24,30,32) |
| InChIKey | YVWAUKGCFJBKLO-UHFFFAOYSA-N |
| Literature Reference Author | C.LEJEUNE,H.TIAN,J.APPENSELLER,L.ERMOLENKO,M.T.MARTIN,A.AL-M OURABIT |
| Literature Reference Citation | J.NAT.PROD.,76,903(2013) |
| Literature Reference DOI | 10.1021/np400048r |
| Molecular Weight | 460.498 g/mol |
| Sample ID | 42514 |
| Solvent | CD3COOD |