| SpectraBase Compound ID | APUS2vVfAek |
|---|---|
| InChI | InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22?,24+,25+,26?,27+,28-,29+,31?,32+,33-,34+,35?/m1/s1 |
| InChIKey | QFEWDYKEKVVRHZ-IZJSWGAFSA-N |
| Mol Weight | 656.8 g/mol |
| Molecular Formula | C35H48N2O10 |
| Exact Mass | 656.330896 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ClKvRBmSbQu |
|---|---|
| Name | AJADINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H48N2O10 |
| InChI | InChI=1S/C35H48N2O10/c1-7-37-16-32(17-46-30(40)20-10-8-9-11-23(20)36-18(2)38)13-12-25(44-5)34-22-14-21-24(43-4)15-33(41,26(22)27(21)47-19(3)39)35(42,31(34)37)29(45-6)28(32)34/h8-11,21-22,24-29,31,41-42H,7,12-17H2,1-6H3,(H,36,38)/t21-,22?,24+,25+,26?,27+,28-,29+,31?,32+,33-,34+,35?/m1/s1 |
| InChIKey | QFEWDYKEKVVRHZ-IZJSWGAFSA-N |
| Literature Reference Author | J.LU,H.K.DESAI,S.A.ROSS,H.M.SAYED,S.W.PELLETIER |
| Literature Reference Citation | J.NAT.PROD.,56,2098(1993) |
| Literature Reference DOI | 10.1021/np50102a011 |
| Molecular Weight | 656.774 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS15613 |