| SpectraBase Compound ID | CGY8DICEoZ7 |
|---|---|
| InChI | InChI=1S/C27H37NO7/c1-6-11(2)22(32)35-15-9-26-18-14-8-25-7-12(3)16(17(30)19(25)26)20(31)27(25,33)23(26)28(14)10-24(18,5)21(15)34-13(4)29/h11,14-21,23,30-31,33H,3,6-10H2,1-2,4-5H3/t11?,14-,15+,16+,17+,18+,19+,20+,21+,23-,24-,25+,26-,27+/m0/s1 |
| InChIKey | AFNCJAGURSSCGO-ADJIQSDPSA-N |
| Mol Weight | 487.6 g/mol |
| Molecular Formula | C27H37NO7 |
| Exact Mass | 487.257003 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KOXDO9ECmHf |
|---|---|
| Name | 9-DEOXYGLANDULINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H37NO7 |
| InChI | InChI=1S/C27H37NO7/c1-6-11(2)22(32)35-15-9-26-18-14-8-25-7-12(3)16(17(30)19(25)26)20(31)27(25,33)23(26)28(14)10-24(18,5)21(15)34-13(4)29/h11,14-21,23,30-31,33H,3,6-10H2,1-2,4-5H3/t11?,14-,15+,16+,17+,18+,19+,20+,21+,23-,24-,25+,26-,27+/m0/s1 |
| InChIKey | AFNCJAGURSSCGO-ADJIQSDPSA-N |
| Literature Reference Author | L.RUIZ-MESIA,A.MADIAVEITIA,M.REINA,M.L.RODRIGUEZ,G.DELAFUENT E,W.RUIZ-MESIA |
| Literature Reference Citation | J.NAT.PROD.,65,496(2002) |
| Literature Reference DOI | 10.1021/np0103416 |
| Molecular Weight | 487.593 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSI5565 |