| SpectraBase Compound ID | JNIix1JahnZ |
|---|---|
| InChI | InChI=1S/C33H42N2O10/c1-16(36)35-21-9-7-6-8-18(21)28(38)44-15-30-11-10-23(42-4)32-20-12-19-22(41-3)13-31(39,24(20)25(19)45-17(2)37)33(40,29(32)34-14-30)27(43-5)26(30)32/h6-9,14,19-20,22-27,29,39-40H,10-13,15H2,1-5H3,(H,35,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29?,30+,31-,32+,33+/m1/s1 |
| InChIKey | JWXKYGKJJZXYFA-CEQHIULQSA-N |
| Mol Weight | 626.7 g/mol |
| Molecular Formula | C33H42N2O10 |
| Exact Mass | 626.283946 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 51SEE8aQhVl |
|---|---|
| Name | AJADINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42N2O10 |
| InChI | InChI=1S/C33H42N2O10/c1-16(36)35-21-9-7-6-8-18(21)28(38)44-15-30-11-10-23(42-4)32-20-12-19-22(41-3)13-31(39,24(20)25(19)45-17(2)37)33(40,29(32)34-14-30)27(43-5)26(30)32/h6-9,14,19-20,22-27,29,39-40H,10-13,15H2,1-5H3,(H,35,36)/t19-,20-,22+,23+,24-,25+,26-,27+,29?,30+,31-,32+,33+/m1/s1 |
| InChIKey | JWXKYGKJJZXYFA-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 | 626.704 g/mol |
| Solvent | Unknown |
| Source File Reference | UWFP605 |