| SpectraBase Compound ID | DiAgTOWiTsO |
|---|---|
| InChI | InChI=1S/C38H55NO8S/c1-22(24(3)35(40)39-34(36(41)42)26-10-12-27(46-7)13-11-26)8-9-23(2)29-16-17-31-28-14-15-30-25(4)33(47-48(43,44)45)19-21-38(30,6)32(28)18-20-37(29,31)5/h10-13,22-23,25,29-30,32-34H,3,8-9,14-21H2,1-2,4-7H3,(H,39,40)(H,41,42)(H,43,44,45)/t22?,23-,25+,29-,30?,32?,33+,34-,37-,38+/m1/s1 |
| InChIKey | CTLYWHGEOLQVMU-PWRJXXGRSA-N |
| Mol Weight | 685.9 g/mol |
| Molecular Formula | C38H55NO8S |
| Exact Mass | 685.364839 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D9uZ7HEbWcw |
|---|---|
| Name | POLYMASTIAMIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H55NO8S |
| InChI | InChI=1S/C38H55NO8S/c1-22(24(3)35(40)39-34(36(41)42)26-10-12-27(46-7)13-11-26)8-9-23(2)29-16-17-31-28-14-15-30-25(4)33(47-48(43,44)45)19-21-38(30,6)32(28)18-20-37(29,31)5/h10-13,22-23,25,29-30,32-34H,3,8-9,14-21H2,1-2,4-7H3,(H,39,40)(H,41,42)(H,43,44,45)/t22?,23-,25+,29-,30?,32?,33+,34-,37-,38+/m1/s1 |
| InChIKey | CTLYWHGEOLQVMU-PWRJXXGRSA-N |
| Literature Reference Author | F.KONG,R.J.ANDERSEN |
| Literature Reference Citation | J.ORG.CHEM.,58,6924(1993) |
| Literature Reference DOI | 10.1021/jo00076a073 |
| Molecular Weight | 685.917 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWGE2978 |