![UA-[ACETONIDE]-UB-PENTAFLUOROPHENYL-CRYPTOPHYCIN-52](/api/spectrum/Iyl6Zfxmn3p/structure.png?h=300&w=458 "UA-[ACETONIDE]-UB-PENTAFLUOROPHENYL-CRYPTOPHYCIN-52")
| SpectraBase Compound ID | EQ8byTU1kF5 |
|---|---|
| InChI | InChI=1S/C38H45F5N2O8/c1-19(2)16-25-35(48)50-24(20(3)32-33(53-38(6,7)52-32)21-12-9-8-10-13-21)14-11-15-26(46)45-23(34(47)44-18-37(4,5)36(49)51-25)17-22-27(39)29(41)31(43)30(42)28(22)40/h8-13,15,19-20,23-25,32-33H,14,16-18H2,1-7H3,(H,44,47)(H,45,46)/b15-11+/t20-,23+,24-,25-,32+,33+/m0/s1 |
| InChIKey | SRPXWMFZTDTPJS-BBFVFLBBSA-N |
| Mol Weight | 752.8 g/mol |
| Molecular Formula | C38H45F5N2O8 |
| Exact Mass | 752.309607 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Iyl6Zfxmn3p |
|---|---|
| Name | UA-[ACETONIDE]-UB-PENTAFLUOROPHENYL-CRYPTOPHYCIN-52 |
| Compound Number | 30 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H45F5N2O8 |
| InChI | InChI=1S/C38H45F5N2O8/c1-19(2)16-25-35(48)50-24(20(3)32-33(53-38(6,7)52-32)21-12-9-8-10-13-21)14-11-15-26(46)45-23(34(47)44-18-37(4,5)36(49)51-25)17-22-27(39)29(41)31(43)30(42)28(22)40/h8-13,15,19-20,23-25,32-33H,14,16-18H2,1-7H3,(H,44,47)(H,45,46)/b15-11+/t20-,23+,24-,25-,32+,33+/m0/s1 |
| InChIKey | SRPXWMFZTDTPJS-BBFVFLBBSA-N |
| Literature Reference Author | C.WEIB,T.BOGNER,B.SAMMET,N.SEWALD |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,8,2060(2012) |
| Literature Reference DOI | 10.3762/bjoc.8.231 |
| Solvent | CDCl3 |
| Source File Reference | UWIR11296 |