| SpectraBase Compound ID | JxFwz2vslCj |
|---|---|
| InChI | InChI=1S/C39H44N4O8/c1-20(39-26-14-32-38(17-30(43(39)51-39)23(26)19-50-32)25-10-6-8-12-29(25)42(48-4)35(38)45)15-36(2,46)33-21-13-31-37(16-27(40-33)22(21)18-49-31)24-9-5-7-11-28(24)41(47-3)34(37)44/h5-12,20-23,26-27,30-32,46H,13-19H2,1-4H3/t20?,21-,22-,23+,26-,27+,30+,31-,32-,36?,37-,38-,39-,43?/m0/s1 |
| InChIKey | QNSZKXIWPRPXNZ-BQISACATSA-N |
| Mol Weight | 696.8 g/mol |
| Molecular Formula | C39H44N4O8 |
| Exact Mass | 696.315914 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A0cr2muP3TA |
|---|---|
| Name | GELEGANIMINE_B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H44N4O8 |
| InChI | InChI=1S/C39H44N4O8/c1-20(39-26-14-32-38(17-30(43(39)51-39)23(26)19-50-32)25-10-6-8-12-29(25)42(48-4)35(38)45)15-36(2,46)33-21-13-31-37(16-27(40-33)22(21)18-49-31)24-9-5-7-11-28(24)41(47-3)34(37)44/h5-12,20-23,26-27,30-32,46H,13-19H2,1-4H3/t20?,21-,22-,23+,26-,27+,30+,31-,32-,36?,37-,38-,39-,43?/m0/s1 |
| InChIKey | QNSZKXIWPRPXNZ-BQISACATSA-N |
| Literature Reference Author | J.QU,L.FANG,X.D.REN,Y.LIU,S.S.YU,L.LI,X.Q.BAO,D.ZHANG,Y.LI,S .G.MA |
| Literature Reference Citation | J.NAT.PROD.,76,2203(2013) |
| Literature Reference DOI | 10.1021/np4005536 |
| Molecular Weight | 696.800 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ43529 |