| SpectraBase Compound ID | 2KT2cWWTm4J |
|---|---|
| InChI | InChI=1S/C17H29NO11/c1-3-17(2,6-18)29-16-14(25)12(23)10(21)8(28-16)5-26-15-13(24)11(22)9(20)7(4-19)27-15/h7-16,19-25H,3-5H2,1-2H3/t7-,8-,9?,10?,11-,12-,13-,14-,15?,16+,17?/m1/s1 |
| InChIKey | WOSYVGNDRYBQCQ-AYLHNTNHSA-N |
| Mol Weight | 423.42 g/mol |
| Molecular Formula | C17H29NO11 |
| Exact Mass | 423.174061 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5evcSZBATSO |
|---|---|
| Name | Neolinustatin(R) |
| CAS Registry Number | 72229-42-6 |
| Comments | broad-band decoupling (BB) |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C17H29NO11 |
| InChI | InChI=1S/C17H29NO11/c1-3-17(2,6-18)29-16-14(25)12(23)10(21)8(28-16)5-26-15-13(24)11(22)9(20)7(4-19)27-15/h7-16,19-25H,3-5H2,1-2H3/t7-,8-,9?,10?,11-,12-,13-,14-,15?,16+,17?/m1/s1 |
| InChIKey | WOSYVGNDRYBQCQ-AYLHNTNHSA-N |
| Instrument Name | SF = 090 MHz |
| Literature Reference | J. Org. Chem. 45, 507 (1980). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | D2O |