| SpectraBase Compound ID | JKmwhAe3vcF |
|---|---|
| InChI | InChI=1S/C81H138N18O16/c1-48(2)43-53(47-96-39-30-38-95-37-29-34-61(95)96)85-69(110)76(11,12)89-64(105)55(45-50(5)6)86-62(103)51(7)84-68(109)75(9,10)90-66(107)57-32-25-28-42-99(57)74(115)81(21,22)94-71(112)78(15,16)88-60(102)46-83-59(101)35-36-82-63(104)54(44-49(3)4)87-70(111)77(13,14)93-72(113)79(17,18)91-67(108)58-33-24-27-41-98(58)73(114)80(19,20)92-65(106)56-31-23-26-40-97(56)52(8)100/h48-51,53-58H,23-47H2,1-22H3,(H12-,82,83,84,85,86,87,88,89,90,91,92,93,94,101,102,103,104,105,106,107,108,109,110,111,112,113)/p+1 |
| InChIKey | FPZWWNKQAQRXAV-UHFFFAOYSA-O |
| Mol Weight | 1621.1 g/mol |
| Molecular Formula | C81H139N18O16 |
| Exact Mass | 1620.061645 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8GVRBRQ2nQ1 |
|---|---|
| Name | EFRAPEPTIN_J |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C81H139N18O16 |
| InChI | InChI=1S/C81H138N18O16/c1-48(2)43-53(47-96-39-30-38-95-37-29-34-61(95)96)85-69(110)76(11,12)89-64(105)55(45-50(5)6)86-62(103)51(7)84-68(109)75(9,10)90-66(107)57-32-25-28-42-99(57)74(115)81(21,22)94-71(112)78(15,16)88-60(102)46-83-59(101)35-36-82-63(104)54(44-49(3)4)87-70(111)77(13,14)93-72(113)79(17,18)91-67(108)58-33-24-27-41-98(58)73(114)80(19,20)92-65(106)56-31-23-26-40-97(56)52(8)100/h48-51,53-58H,23-47H2,1-22H3,(H12-,82,83,84,85,86,87,88,89,90,91,92,93,94,101,102,103,104,105,106,107,108,109,110,111,112,113)/p+1 |
| InChIKey | FPZWWNKQAQRXAV-UHFFFAOYSA-O |
| Literature Reference Author | Y.HAYAKAWA,Y.HATTORI,T.KAWASAKI,K.KANOH,K.ADACHI,Y.SHIZURI,K .SHIN-YA |
| Literature Reference Citation | J.ANTIBIOTICS,61,365(2008) |
| Literature Reference DOI | 10.1038/ja.2008.51 |
| Molecular Weight | 1621.106 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMB341 |