| SpectraBase Compound ID | HMTYLaqDbta |
|---|---|
| InChI | InChI=1S/C23H44N6O13/c24-4-10-14(33)16(35)17(36)23(39-10)41-19-7(26)3-8(29-21(38)9(31)1-2-28-6-25)20(18(19)37)42-22-15(34)12(27)13(32)11(5-30)40-22/h6-20,22-23,30-37H,1-5,24,26-27H2,(H2,25,28)(H,29,38)/t7-,8+,9-,10+,11+,12-,13+,14+,15+,16-,17+,18-,19+,20-,22+,23+/m0/s1 |
| InChIKey | BQZDIGVLZZAJSH-KTBBFJJQSA-N |
| Mol Weight | 612.6 g/mol |
| Molecular Formula | C23H44N6O13 |
| Exact Mass | 612.296635 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | jhZiCQb8ev |
|---|---|
| Name | 1-N-(4-AMIDINO-2-HYDROXYBUTYRYL)-KANAMYCIN-A |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H44N6O13 |
| InChI | InChI=1S/C23H44N6O13/c24-4-10-14(33)16(35)17(36)23(39-10)41-19-7(26)3-8(29-21(38)9(31)1-2-28-6-25)20(18(19)37)42-22-15(34)12(27)13(32)11(5-30)40-22/h6-20,22-23,30-37H,1-5,24,26-27H2,(H2,25,28)(H,29,38)/t7-,8+,9-,10+,11+,12-,13+,14+,15+,16-,17+,18-,19+,20-,22+,23+/m0/s1 |
| InChIKey | BQZDIGVLZZAJSH-KTBBFJJQSA-N |
| Literature Reference Author | T.YAMASAKI,Y.NARITA,H.HOSHI,S.ABURAKI,H.KAMEI,T.NAITO,H.KAWA GUCHI |
| Literature Reference Citation | J.ANTIBIOTICS,44,646(1991) |
| Literature Reference DOI | 10.7164/antibiotics.44.646 |
| Molecular Weight | 612.635 g/mol |
| Sample ID | 66501 |
| Solvent | D2O;PH=2 |