| SpectraBase Compound ID | 5lo2Sq8cjOI |
|---|---|
| InChI | InChI=1S/C44H65NO13/c1-23(2)41-28(7)35(56-37(49)18-17-36(48)45-38-31(46)15-16-32(38)47)22-44(53,58-41)30(9)40(51)29(8)42-33(54-10)14-12-13-24(3)19-26(5)39(50)27(6)20-25(4)21-34(55-11)43(52)57-42/h12-14,17-18,20-21,23,26-30,33,35,39-42,46,50-51,53H,15-16,19,22H2,1-11H3,(H,45,48)/b14-12+,18-17+,24-13+,25-20+,34-21-/t26-,27-,28+,29+,30+,33+,35-,39+,40-,41-,42-,44+/m1/s1 |
| InChIKey | KFUFLYSBMNNJTF-VRLJCEJLSA-N |
| Mol Weight | 816.0 g/mol |
| Molecular Formula | C44H65NO13 |
| Exact Mass | 815.445591 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXTSOqiY2lO |
|---|---|
| Name | BAFILOMYCIN-B1 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H65NO13 |
| InChI | InChI=1S/C44H65NO13/c1-23(2)41-28(7)35(56-37(49)18-17-36(48)45-38-31(46)15-16-32(38)47)22-44(53,58-41)30(9)40(51)29(8)42-33(54-10)14-12-13-24(3)19-26(5)39(50)27(6)20-25(4)21-34(55-11)43(52)57-42/h12-14,17-18,20-21,23,26-30,33,35,39-42,46,50-51,53H,15-16,19,22H2,1-11H3,(H,45,48)/b14-12+,18-17+,24-13+,25-20+,34-21-/t26-,27-,28+,29+,30+,33+,35-,39+,40-,41-,42-,44+/m1/s1 |
| InChIKey | KFUFLYSBMNNJTF-VRLJCEJLSA-N |
| Literature Reference Author | T.SCHUHMANN,S.GROND |
| Literature Reference Citation | J.ANTIBIOTICS,57,655(2004) |
| Literature Reference DOI | 10.7164/antibiotics.57.655 |
| Molecular Weight | 815.999 g/mol |
| Sample ID | 65796 |
| Solvent | CD2Cl2 |