![9-(2-Acetamido-2-deoxy-3-O-[B-D-galactopyranosyl]-B-D-glucopyranosid-1-O-yl)-nonanoate](/api/spectrum/9BkKn8DA9Wq/structure.png?h=300&w=458 "9-(2-Acetamido-2-deoxy-3-O-[B-D-galactopyranosyl]-B-D-glucopyranosid-1-O-yl)-nonanoate")
| SpectraBase Compound ID | EMVndpgBp2G |
|---|---|
| InChI | InChI=1S/C23H41NO13/c1-12(27)24-16-21(37-23-20(33)19(32)17(30)13(10-25)36-23)18(31)14(11-26)35-22(16)34-9-7-5-3-2-4-6-8-15(28)29/h13-14,16-23,25-26,30-33H,2-11H2,1H3,(H,24,27)(H,28,29)/p-1/t13-,14-,16-,17+,18-,19+,20-,21-,22-,23+/m1/s1 |
| InChIKey | QSHGZHOVGZEDFX-LCWXKJGSSA-M |
| Mol Weight | 538.6 g/mol |
| Molecular Formula | C23H40NO13 |
| Exact Mass | 538.249965 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9BkKn8DA9Wq |
|---|---|
| Name | 9-(2-Acetamido-2-deoxy-3-O-[B-D-galactopyranosyl]-B-D-glucopyranosid-1-O-yl)-nonanoate |
| Comments | SODIUM SALT, REASSIGNED (A.H.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C23H40NO13 |
| InChI | InChI=1S/C23H41NO13/c1-12(27)24-16-21(37-23-20(33)19(32)17(30)13(10-25)36-23)18(31)14(11-26)35-22(16)34-9-7-5-3-2-4-6-8-15(28)29/h13-14,16-23,25-26,30-33H,2-11H2,1H3,(H,24,27)(H,28,29)/p-1/t13-,14-,16-,17+,18-,19+,20-,21-,22-,23+/m1/s1 |
| InChIKey | QSHGZHOVGZEDFX-LCWXKJGSSA-M |
| Instrument Name | Bruker HX-10 |
| Literature Reference | R.U. Lemieux, D.R. Bundle, D.A.Baker, J. Am. Chem. Soc. 97, 4076 (1975). |
| NMR Standard | TMS Ext. |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |