| SpectraBase Compound ID | Cr754p7SlIE |
|---|---|
| InChI | InChI=1S/C16H24N2O16/c19-7(15(29)30)3-11(25)33-17-5(1-9(21)22)13(27)14(28)6(2-10(23)24)18-34-12(26)4-8(20)16(31)32/h5-8,13-14,17-20,27-28H,1-4H2,(H,21,22)(H,23,24)(H,29,30)(H,31,32) |
| InChIKey | KUBGDPRHXHQPBZ-UHFFFAOYSA-N |
| Mol Weight | 500.37 g/mol |
| Molecular Formula | C16H24N2O16 |
| Exact Mass | 500.112583 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | L5oAIHL7xz1 |
|---|---|
| Name | KMC;KALANCHOSINE_DIMALATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H24N2O16 |
| InChI | InChI=1S/C16H24N2O16/c19-7(15(29)30)3-11(25)33-17-5(1-9(21)22)13(27)14(28)6(2-10(23)24)18-34-12(26)4-8(20)16(31)32/h5-8,13-14,17-20,27-28H,1-4H2,(H,21,22)(H,23,24)(H,29,30)(H,31,32) |
| InChIKey | KUBGDPRHXHQPBZ-UHFFFAOYSA-N |
| Literature Reference Author | S.S.COSTA,M.D.L.M.D.SOUZA,T.IBRAHIM,G.O.D.MELO,A.P.D.ALMEIDA .C.GUETTE,J.P.FEREZO |
| Literature Reference Citation | J.NAT.PROD.,69,815(2006) |
| Literature Reference DOI | 10.1021/np050475+ |
| Molecular Weight | 500.370 g/mol |
| Solvent | D2O |
| Source File Reference | UWMZ18425 |