| SpectraBase Compound ID | FU7zf9s0D8p |
|---|---|
| InChI | InChI=1S/C38H48N8O6S2/c1-8-19(4)28-36-46-30(22(7)52-36)34(50)41-25(15-23-12-10-9-11-13-23)38-43-26(17-54-38)31(47)40-24(14-18(2)3)35-45-29(21(6)51-35)33(49)39-20(5)37-42-27(16-53-37)32(48)44-28/h9-13,16-22,24-25,28-30H,8,14-15H2,1-7H3,(H,39,49)(H,40,47)(H,41,50)(H,44,48)/t19?,20-,21-,22-,24+,25-,28+,29+,30+/m1/s1 |
| InChIKey | FDAPKNJHIHKHDM-FGHJXDJZSA-N |
| Mol Weight | 777.0 g/mol |
| Molecular Formula | C38H48N8O6S2 |
| Exact Mass | 776.313824 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IPGTl2Ekfsc |
|---|---|
| Name | PATELLAMIDE_B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H48N8O6S2 |
| InChI | InChI=1S/C38H48N8O6S2/c1-8-19(4)28-36-46-30(22(7)52-36)34(50)41-25(15-23-12-10-9-11-13-23)38-43-26(17-54-38)31(47)40-24(14-18(2)3)35-45-29(21(6)51-35)33(49)39-20(5)37-42-27(16-53-37)32(48)44-28/h9-13,16-22,24-25,28-30H,8,14-15H2,1-7H3,(H,39,49)(H,40,47)(H,41,50)(H,44,48)/t19?,20-,21-,22-,24+,25-,28+,29+,30+/m1/s1 |
| InChIKey | FDAPKNJHIHKHDM-FGHJXDJZSA-N |
| Literature Reference Author | T.ISHIDA,Y.IN,F.SHINOZAKI,M.DOI,D.YAMAMOTO,Y.HAMADA,T.SHIOIR I,M.KAMIGAUCHI,M.SUG |
| Literature Reference Citation | J.ORG.CHEM.,60,3944(1995) |
| Literature Reference DOI | 10.1021/jo00118a007 |
| Molecular Weight | 776.969 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ2270 |