| SpectraBase Compound ID | LVe1lU4LJiu |
|---|---|
| InChI | InChI=1S/C30H27NO9/c1-18(32)31-22-23(38-28(33)19-11-5-2-6-12-19)25-26(37-17-36-25)27(40-30(35)21-15-9-4-10-16-21)24(22)39-29(34)20-13-7-3-8-14-20/h2-16,22-27H,17H2,1H3,(H,31,32)/t22-,23+,24-,25-,26-,27+/m1/s1 |
| InChIKey | BKSBYOWDQODHLN-HXPCJYLWSA-N |
| Mol Weight | 545.54 g/mol |
| Molecular Formula | C30H27NO9 |
| Exact Mass | 545.168581 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IqSZXYBA822 |
|---|---|
| Name | N-ACETYL-O-METHYLENE-NEOINOSAMINE-2-1,3,6-O-TRIBENZOATE |
| Compound Number | V |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H27NO9 |
| InChI | InChI=1S/C30H27NO9/c1-18(32)31-22-23(38-28(33)19-11-5-2-6-12-19)25-26(37-17-36-25)27(40-30(35)21-15-9-4-10-16-21)24(22)39-29(34)20-13-7-3-8-14-20/h2-16,22-27H,17H2,1H3,(H,31,32)/t22-,23+,24-,25-,26-,27+/m1/s1 |
| InChIKey | BKSBYOWDQODHLN-HXPCJYLWSA-N |
| Literature Reference Author | K.KAKINUMA,Y.SAKAGAMI |
| Literature Reference Citation | AGR.BIOL.CHEM.,42,279(1978) |
| Literature Reference DOI | 10.1271/bbb1961.42.279 |
| Molecular Weight | 545.546 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT8632 |