| SpectraBase Compound ID | 9JdpRCmGkwK |
|---|---|
| InChI | InChI=1S/C33H46N2O9/c1-6-35-15-30(16-44-28(38)18-9-7-8-10-21(18)34-17(2)36)12-11-23(42-4)32-20-13-19-22(41-3)14-31(39,24(20)25(19)37)33(40,29(32)35)27(43-5)26(30)32/h7-10,19-20,22-27,29,37,39-40H,6,11-16H2,1-5H3,(H,34,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29?,30+,31-,32+,33+/m1/s1 |
| InChIKey | GVZZOVYQNAEUTQ-CEQHIULQSA-N |
| Mol Weight | 614.7 g/mol |
| Molecular Formula | C33H46N2O9 |
| Exact Mass | 614.320331 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8YOEHycHsRn |
|---|---|
| Name | 14-DEACETYLAJADINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46N2O9 |
| InChI | InChI=1S/C33H46N2O9/c1-6-35-15-30(16-44-28(38)18-9-7-8-10-21(18)34-17(2)36)12-11-23(42-4)32-20-13-19-22(41-3)14-31(39,24(20)25(19)37)33(40,29(32)35)27(43-5)26(30)32/h7-10,19-20,22-27,29,37,39-40H,6,11-16H2,1-5H3,(H,34,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29?,30+,31-,32+,33+/m1/s1 |
| InChIKey | GVZZOVYQNAEUTQ-CEQHIULQSA-N |
| Literature Reference Author | H.K.DESAI,B.T.CARTWRIGHT,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,57,677(1994) |
| Literature Reference DOI | 10.1021/np50107a022 |
| Molecular Weight | 614.736 g/mol |
| Solvent | Unknown |
| Source File Reference | UWFP606 |