| SpectraBase Compound ID | Ev8KBi1F0dZ |
|---|---|
| InChI | InChI=1S/C46H76O11/c1-12-34-18-16-14-15-17-28(5)43(52)45(11,54)44(53)33(10)41(51)32(9)40(50)31(8)39(49)27(4)19-22-38(48)55-42-30(7)36(21-20-34)56-46(35(42)13-2)24-23-26(3)37(57-46)25-29(6)47/h14-16,18-19,22,26-37,39,41-43,47,49,51-52,54H,12-13,17,20-21,23-25H2,1-11H3/b15-14+,18-16+,22-19+/t26-,27-,28+,29+,30+,31-,32-,33-,34-,35-,36-,37+,39+,41+,42+,43-,45+,46-/m1/s1 |
| InChIKey | APJPYXAUMOLFTM-KBMJDHDHSA-N |
| Mol Weight | 805.1 g/mol |
| Molecular Formula | C46H76O11 |
| Exact Mass | 804.538763 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Ybr5PzBGAW |
|---|---|
| Name | NK-86-0279-II;44-HOMO-OLIGOMYCIN-A |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H76O11 |
| InChI | InChI=1S/C46H76O11/c1-12-34-18-16-14-15-17-28(5)43(52)45(11,54)44(53)33(10)41(51)32(9)40(50)31(8)39(49)27(4)19-22-38(48)55-42-30(7)36(21-20-34)56-46(35(42)13-2)24-23-26(3)37(57-46)25-29(6)47/h14-16,18-19,22,26-37,39,41-43,47,49,51-52,54H,12-13,17,20-21,23-25H2,1-11H3/b15-14+,18-16+,22-19+/t26-,27-,28+,29+,30+,31-,32-,33-,34-,35-,36-,37+,39+,41+,42+,43-,45+,46-/m1/s1 |
| InChIKey | APJPYXAUMOLFTM-KBMJDHDHSA-N |
| Literature Reference Author | M.YAMAZAKI,T.YAMASHITA,T.HARADA,T.NISHIKIORI,S.SAITO,N.SHIMA DA,A.FUJII |
| Literature Reference Citation | J.ANTIBIOTICS,45,171(1992) |
| Literature Reference DOI | 10.7164/antibiotics.45.171 |
| Molecular Weight | 805.103 g/mol |
| Sample ID | 45817 |
| Solvent | CDCl3 |