| SpectraBase Compound ID | CXcDpNCAQVK |
|---|---|
| InChI | InChI=1S/C83H142N18O16/c1-23-82(21,73(114)87-55(45-50(3)4)49-98-41-32-40-97-39-31-36-63(97)98)93-66(107)57(47-52(7)8)88-64(105)53(9)86-70(111)77(11,12)91-68(109)59-34-26-29-43-100(59)76(117)81(19,20)95-72(113)79(15,16)90-62(104)48-85-61(103)37-38-84-65(106)56(46-51(5)6)89-71(112)78(13,14)96-74(115)83(22,24-2)94-69(110)60-35-27-30-44-101(60)75(116)80(17,18)92-67(108)58-33-25-28-42-99(58)54(10)102/h50-53,55-60H,23-49H2,1-22H3,(H12-,84,85,86,87,88,89,90,91,92,93,94,95,96,103,104,105,106,107,108,109,110,111,112,113,114,115)/p+1/t53-,55-,56+,57-,58+,59+,60+,82-,83+/m0/s1 |
| InChIKey | MYYCGBYRWZBSPN-SYJVWFHJSA-O |
| Mol Weight | 1649.2 g/mol |
| Molecular Formula | C83H143N18O16 |
| Exact Mass | 1648.092946 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4HJcGjwqIaU |
|---|---|
| Name | EFRAPEPTIN_G |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C83H143N18O16 |
| InChI | InChI=1S/C83H142N18O16/c1-23-82(21,73(114)87-55(45-50(3)4)49-98-41-32-40-97-39-31-36-63(97)98)93-66(107)57(47-52(7)8)88-64(105)53(9)86-70(111)77(11,12)91-68(109)59-34-26-29-43-100(59)76(117)81(19,20)95-72(113)79(15,16)90-62(104)48-85-61(103)37-38-84-65(106)56(46-51(5)6)89-71(112)78(13,14)96-74(115)83(22,24-2)94-69(110)60-35-27-30-44-101(60)75(116)80(17,18)92-67(108)58-33-25-28-42-99(58)54(10)102/h50-53,55-60H,23-49H2,1-22H3,(H12-,84,85,86,87,88,89,90,91,92,93,94,95,96,103,104,105,106,107,108,109,110,111,112,113,114,115)/p+1/t53-,55-,56+,57-,58+,59+,60+,82-,83+/m0/s1 |
| InChIKey | MYYCGBYRWZBSPN-SYJVWFHJSA-O |
| Literature Reference Author | C.M.BOOT,K.TENNEY,F.A.VALERIOTE,P.CREWS |
| Literature Reference Citation | J.NAT.PROD.,69,83(2006) |
| Literature Reference DOI | 10.1021/np0503653 |
| Molecular Weight | 1649.159 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ18068 |