| SpectraBase Compound ID | Jm9rUHTmnlg |
|---|---|
| InChI | InChI=1S/C40H46N4O6/c1-5-19-15-43-31-13-39(37(43)45,35-9-21(19)25(31)17-49-35)27-7-23(33(47-3)11-29(27)41)24-8-28(30(42)12-34(24)48-4)40-14-32-26-18-50-36(40)10-22(26)20(6-2)16-44(32)38(40)46/h5-8,11-12,21-22,25-26,31-32,35-36H,9-10,13-18,41-42H2,1-4H3/b19-5-,20-6+/t21-,22+,25+,26-,31+,32-,35+,36-,39-,40+/m0/s1 |
| InChIKey | WMPVUMKMYYEBTP-SLRLKGGKSA-N |
| Mol Weight | 678.8 g/mol |
| Molecular Formula | C40H46N4O6 |
| Exact Mass | 678.341735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1g6f14IgIp0 |
|---|---|
| Name | GELEGANAMIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H46N4O6 |
| InChI | InChI=1S/C40H46N4O6/c1-5-19-15-43-31-13-39(37(43)45,35-9-21(19)25(31)17-49-35)27-7-23(33(47-3)11-29(27)41)24-8-28(30(42)12-34(24)48-4)40-14-32-26-18-50-36(40)10-22(26)20(6-2)16-44(32)38(40)46/h5-8,11-12,21-22,25-26,31-32,35-36H,9-10,13-18,41-42H2,1-4H3/b19-5-,20-6+/t21-,22+,25+,26-,31+,32-,35+,36-,39-,40+/m0/s1 |
| InChIKey | WMPVUMKMYYEBTP-SLRLKGGKSA-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 | 678.828 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ43530 |