SpectraBase Compound ID | 7elCxW7iHyO |
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InChI | InChI=1S/C46H66N4O12/c1-27(16-17-50(7)26-51)18-30(4)37(53)15-14-29(3)40(57-9)22-41-32(6)39(56-8)12-11-13-42-47-35(24-59-42)45-49-36(25-61-45)46-48-34(23-60-46)44(58-10)31(5)38(54)20-28(2)19-33(52)21-43(55)62-41/h11,13,16-18,23-29,31-33,38-41,44,52,54H,12,14-15,19-22H2,1-10H3/b13-11+,17-16+,30-18+/t27-,28+,29+,31+,32-,33+,38+,39+,40+,41+,44-/m1/s1 |
InChIKey | BURLCNUJBHPOOO-RUWUMMDESA-N |
Mol Weight | 867.0 g/mol |
Molecular Formula | C46H66N4O12 |
Exact Mass | 866.467724 g/mol |
SpectraBase Spectrum ID | FPu0iFMMfcK |
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Name | KABIRAMIDE_K;MAJOR_CONFORMER |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C46H66N4O12 |
InChI | InChI=1S/C46H66N4O12/c1-27(16-17-50(7)26-51)18-30(4)37(53)15-14-29(3)40(57-9)22-41-32(6)39(56-8)12-11-13-42-47-35(24-59-42)45-49-36(25-61-45)46-48-34(23-60-46)44(58-10)31(5)38(54)20-28(2)19-33(52)21-43(55)62-41/h11,13,16-18,23-29,31-33,38-41,44,52,54H,12,14-15,19-22H2,1-10H3/b13-11+,17-16+,30-18+/t27-,28+,29+,31+,32-,33+,38+,39+,40+,41+,44-/m1/s1 |
InChIKey | BURLCNUJBHPOOO-RUWUMMDESA-N |
Literature Reference Author | T.SIRIRAK,S.KITTIWISUT,C.JANMA,S.YUENYONGSAWAD,K.SUWANBORIRU X,A.PLUBRUKARN |
Literature Reference Citation | J.NAT.PROD.,74,1288(2011) |
Literature Reference DOI | 10.1021/np100886y |
Molecular Weight | 867.050 g/mol |
Sample ID | 38353 |
Solvent | C6D6 |