| SpectraBase Compound ID | INCNbA0UbNf |
|---|---|
| InChI | InChI=1S/C35H59NO17/c1-5-6-9-20(3)33(53-31(46)17-23(35(50)51)15-29(43)44)27(52-30(45)16-22(34(48)49)14-28(41)42)13-19(2)12-24(38)10-7-8-11-25(39)32(47)26(40)18-36-21(4)37/h19-20,22-27,32-33,38-40,47H,5-18H2,1-4H3,(H,36,37)(H,41,42)(H,43,44)(H,48,49)(H,50,51) |
| InChIKey | IAKTYBFSIRNZQT-UHFFFAOYSA-N |
| Mol Weight | 765.8 g/mol |
| Molecular Formula | C35H59NO17 |
| Exact Mass | 765.378299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATURX2dvjJB |
|---|---|
| Name | N-ACETYL-4-HYDROXY-FUMONISIN-C1 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H59NO17 |
| InChI | InChI=1S/C35H59NO17/c1-5-6-9-20(3)33(53-31(46)17-23(35(50)51)15-29(43)44)27(52-30(45)16-22(34(48)49)14-28(41)42)13-19(2)12-24(38)10-7-8-11-25(39)32(47)26(40)18-36-21(4)37/h19-20,22-27,32-33,38-40,47H,5-18H2,1-4H3,(H,36,37)(H,41,42)(H,43,44)(H,48,49)(H,50,51) |
| InChIKey | IAKTYBFSIRNZQT-UHFFFAOYSA-N |
| Literature Reference Author | J.A.SEO,J.C.KIM,Y.W.LEE |
| Literature Reference Citation | J.NAT.PROD.,62,355(1999) |
| Literature Reference DOI | 10.1021/np980371h |
| Molecular Weight | 765.850 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWCP6175 |