| SpectraBase Compound ID | AGKbAuUlw7m |
|---|---|
| InChI | InChI=1S/C20H35NO14/c22-3-6-1-7(11(26)14(29)10(6)25)21-8-2-20(33,5-24)18(16(31)12(8)27)35-19-17(32)15(30)13(28)9(4-23)34-19/h1,7-19,21-33H,2-5H2/t7-,8+,9-,10+,11-,12+,13-,14-,15+,16-,17-,18+,19+,20+/m1/s1 |
| InChIKey | FKVLATUQODRNIC-RZNKBEBWSA-N |
| Mol Weight | 513.5 g/mol |
| Molecular Formula | C20H35NO14 |
| Exact Mass | 513.205755 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 59QpexTkhRU |
|---|---|
| Name | N-[(1S,2S)-2,3,4-TRIHYDROXY-5-(HYDROXYMETHYL)-5-CYCLOHEXENYL)-4-O-(BETA-D-GLUCOPYRANOSYL)-VALIOLAMINE;VALIDAMYCIN-G |
| CAS Registry Number | 106054-17-5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H35NO14 |
| InChI | InChI=1S/C20H35NO14/c22-3-6-1-7(11(26)14(29)10(6)25)21-8-2-20(33,5-24)18(16(31)12(8)27)35-19-17(32)15(30)13(28)9(4-23)34-19/h1,7-19,21-33H,2-5H2/t7-,8+,9-,10+,11-,12+,13-,14-,15+,16-,17-,18+,19+,20+/m1/s1 |
| InChIKey | FKVLATUQODRNIC-RZNKBEBWSA-N |
| Literature Reference Author | H.FUKASE,S.HORII |
| Literature Reference Citation | J.ORG.CHEM.,57,3651(1992) |
| Literature Reference DOI | 10.1021/jo00039a026 |
| Molecular Weight | 513.496 g/mol |
| Solvent | D2O |
| Source File Reference | UWCS1374 |