![SB-203207;4-(AMINOCARBONYL)-7-{[(2-AMIMO-3-METHYLPENTANOYL)-AMINOSULPHONYL]-ACETAMIDO}-2,4A,5,6,7,7A-HEXAHYDRO-6-HYDROXY-2-METHYL-1H-2-PYRIDINE-7-C](/api/spectrum/8Cf8iG0cvvN/structure.png?h=300&w=458 "SB-203207;4-(AMINOCARBONYL)-7-{[(2-AMIMO-3-METHYLPENTANOYL)-AMINOSULPHONYL]-ACETAMIDO}-2,4A,5,6,7,7A-HEXAHYDRO-6-HYDROXY-2-METHYL-1H-2-PYRIDINE-7-C")
| SpectraBase Compound ID | KjWdurvHILi |
|---|---|
| InChI | InChI=1S/C19H31N5O8S/c1-4-9(2)15(20)17(28)23-33(31,32)8-14(26)22-19(18(29)30)12-7-24(3)6-11(16(21)27)10(12)5-13(19)25/h6,9-10,12-13,15,25H,4-5,7-8,20H2,1-3H3,(H2,21,27)(H,22,26)(H,23,28)(H,29,30)/t9?,10-,12+,13-,15?,19+/m0/s1 |
| InChIKey | HDXFGBFIEQUETL-MEHUXZJYSA-N |
| Mol Weight | 489.54 g/mol |
| Molecular Formula | C19H31N5O8S |
| Exact Mass | 489.189334 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8Cf8iG0cvvN |
|---|---|
| Name | SB-203207;4-(AMINOCARBONYL)-7-{[(2-AMIMO-3-METHYLPENTANOYL)-AMINOSULPHONYL]-ACETAMIDO}-2,4A,5,6,7,7A-HEXAHYDRO-6-HYDROXY-2-METHYL-1H-2-PYRIDINE-7-C |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H31N5O8S |
| InChI | InChI=1S/C19H31N5O8S/c1-4-9(2)15(20)17(28)23-33(31,32)8-14(26)22-19(18(29)30)12-7-24(3)6-11(16(21)27)10(12)5-13(19)25/h6,9-10,12-13,15,25H,4-5,7-8,20H2,1-3H3,(H2,21,27)(H,22,26)(H,23,28)(H,29,30)/t9?,10-,12+,13-,15?,19+/m0/s1 |
| InChIKey | HDXFGBFIEQUETL-MEHUXZJYSA-N |
| Literature Reference Author | C.S.V.HOUGE-FRYDRYCH,M.L.GILPIN,P.W.SKETT,J.W.TYLER |
| Literature Reference Citation | J.ANTIBIOTICS,53,364(2000) |
| Literature Reference DOI | 10.7164/antibiotics.53.364 |
| Molecular Weight | 489.544 g/mol |
| Solvent | D2O |
| Source File Reference | UWBS245 |