| SpectraBase Compound ID | EAI9KaPOQKb |
|---|---|
| InChI | InChI=1S/C36H60O8/c1-20(2)33-26(8)30(42-12)19-36(40,44-33)28(10)32(38)27(9)34-29(41-11)15-13-14-21(3)16-23(5)31(37)24(6)17-22(4)18-25(7)35(39)43-34/h13-15,17-18,20,23-24,26-34,37-38,40H,16,19H2,1-12H3/b15-13+,21-14+,22-17+,25-18+/t23-,24+,26+,27-,28-,29-,30-,31-,32+,33-,34+,36-/m0/s1 |
| InChIKey | PHNJREQYDLKYEB-IJXWPELISA-N |
| Mol Weight | 620.9 g/mol |
| Molecular Formula | C36H60O8 |
| Exact Mass | 620.428819 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LhI43KsTQGh |
|---|---|
| Name | BAFILOMYCIN_J |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H60O8 |
| InChI | InChI=1S/C36H60O8/c1-20(2)33-26(8)30(42-12)19-36(40,44-33)28(10)32(38)27(9)34-29(41-11)15-13-14-21(3)16-23(5)31(37)24(6)17-22(4)18-25(7)35(39)43-34/h13-15,17-18,20,23-24,26-34,37-38,40H,16,19H2,1-12H3/b15-13+,21-14+,22-17+,25-18+/t23-,24+,26+,27-,28-,29-,30-,31-,32+,33-,34+,36-/m0/s1 |
| InChIKey | PHNJREQYDLKYEB-IJXWPELISA-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 | 620.868 g/mol |
| Sample ID | 35090 |
| Solvent | C6D6 |