| SpectraBase Compound ID | Bya9YnnS77i |
|---|---|
| InChI | InChI=1S/C42H65NO13S/c1-21(2)37-26(7)32(54-34(44)18-33-39(47)43-29(20-57-33)40(48)49)19-42(51,56-37)28(9)36(46)27(8)38-30(52-10)14-12-13-22(3)15-24(5)35(45)25(6)16-23(4)17-31(53-11)41(50)55-38/h12-14,16-17,21,24-30,32-33,35-38,45-46,51H,15,18-20H2,1-11H3,(H,43,47)(H,48,49)/b14-12+,22-13+,23-16+,31-17-/t24-,25+,26+,27-,28-,29+,30-,32-,33+,35-,36+,37-,38+,42-/m0/s1 |
| InChIKey | QUPRHGPFIADXHP-JCXANNCBSA-N |
| Mol Weight | 824.0 g/mol |
| Molecular Formula | C42H65NO13S |
| Exact Mass | 823.417662 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8hXXDEExjy9 |
|---|---|
| Name | BAFILOMYCIN_F |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H65NO13S |
| InChI | InChI=1S/C42H65NO13S/c1-21(2)37-26(7)32(54-34(44)18-33-39(47)43-29(20-57-33)40(48)49)19-42(51,56-37)28(9)36(46)27(8)38-30(52-10)14-12-13-22(3)15-24(5)35(45)25(6)16-23(4)17-31(53-11)41(50)55-38/h12-14,16-17,21,24-30,32-33,35-38,45-46,51H,15,18-20H2,1-11H3,(H,43,47)(H,48,49)/b14-12+,22-13+,23-16+,31-17-/t24-,25+,26+,27-,28-,29+,30-,32-,33+,35-,36+,37-,38+,42-/m0/s1 |
| InChIKey | QUPRHGPFIADXHP-JCXANNCBSA-N |
| Literature Reference Author | G.CARR,D.E.WILLIAMS,A.R.DIAZ-MARRERO,B.O.PATRICK,H.BOTTRIELL ,A.D.BALGI,E.DONOHUE |
| Literature Reference Citation | J.NAT.PROD.,73,422(2010) |
| Literature Reference DOI | 10.1021/np900632r |
| Molecular Weight | 824.037 g/mol |
| Sample ID | 35087 |
| Solvent | CD3OD |