| SpectraBase Compound ID | CY6U09Oanrh |
|---|---|
| InChI | InChI=1S/C14H13N5O7/c15-10-7-11(17-3-16-10)19(4-18-7)12-8(22)9-5(25-12)1-14(26-9,13(23)24)2-6(20)21/h1,3-4,8-9,12,22H,2H2,(H,20,21)(H,23,24)(H2,15,16,17)/t8-,9-,12-,14+/m1/s1 |
| InChIKey | WRHIKWNGCJVUOW-MGGABWITSA-N |
| Mol Weight | 363.29 g/mol |
| Molecular Formula | C14H13N5O7 |
| Exact Mass | 363.081498 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E7nJMYjTuy8 |
|---|---|
| Name | GRISEOLIC-ACID-B |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H13N5O7 |
| InChI | InChI=1S/C14H13N5O7/c15-10-7-11(17-3-16-10)19(4-18-7)12-8(22)9-5(25-12)1-14(26-9,13(23)24)2-6(20)21/h1,3-4,8-9,12,22H,2H2,(H,20,21)(H,23,24)(H2,15,16,17)/t8-,9-,12-,14+/m1/s1 |
| InChIKey | WRHIKWNGCJVUOW-MGGABWITSA-N |
| Literature Reference Author | S.KNAPP,M.R.MADDURU,Z.LU,G.J.MORRIELLO,T.J.EMGE,G.A.DOSS |
| Literature Reference Citation | ORG.LETTERS,3,3583(2001) |
| Literature Reference DOI | 10.1021/ol0167210 |
| Molecular Weight | 363.287 g/mol |
| Solvent | D2O |
| Source File Reference | UWVN30798 |