| SpectraBase Compound ID | A79qlgggnlX |
|---|---|
| InChI | InChI=1S/C41H56N2O10/c1-23(2)16-27-18-35(45)52-37-36(53-40(47)41(37,7)22-44)26(6)11-12-28-13-14-31(42-28)38-43-32(34(51-38)21-50-39(27)46)19-29-30(25(5)10-9-15-48-8)20-49-33(29)17-24(3)4/h11,13-14,18-19,23-24,32-34,36-37,42,44H,9-10,12,15-17,20-22H2,1-8H3/b26-11+,27-18+,29-19-,30-25+ |
| InChIKey | LVCBUCRONSGDKJ-IZQVJZSSSA-N |
| Mol Weight | 736.9 g/mol |
| Molecular Formula | C41H56N2O10 |
| Exact Mass | 736.393496 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F8kUV3oIMy |
|---|---|
| Name | LEUPYRRIN-B1 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H56N2O10 |
| InChI | InChI=1S/C41H56N2O10/c1-23(2)16-27-18-35(45)52-37-36(53-40(47)41(37,7)22-44)26(6)11-12-28-13-14-31(42-28)38-43-32(34(51-38)21-50-39(27)46)19-29-30(25(5)10-9-15-48-8)20-49-33(29)17-24(3)4/h11,13-14,18-19,23-24,32-34,36-37,42,44H,9-10,12,15-17,20-22H2,1-8H3/b26-11+,27-18+,29-19-,30-25+ |
| InChIKey | LVCBUCRONSGDKJ-IZQVJZSSSA-N |
| Literature Reference Author | H.B.BODE,H.IRSCHIK,S.C.WENZEL,H.REICHENBACH,R.MUELLER,G.HOEF LE |
| Literature Reference Citation | J.NAT.PROD.,66,1203(2003) |
| Literature Reference DOI | 10.1021/np030109v |
| Molecular Weight | 736.903 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP988 |