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TAMANDARIN-A
SpectraBase Compound ID 8ZwpazBA53Y
InChI InChI=1S/C54H85N7O14/c1-14-32(8)44-42(63)28-43(64)75-46(31(6)7)49(67)55-37(25-29(2)3)51(69)61-24-16-18-39(61)53(71)59(12)41(27-35-19-21-36(73-13)22-20-35)54(72)74-34(10)45(48(66)56-44)57-47(65)40(26-30(4)5)58(11)52(70)38-17-15-23-60(38)50(68)33(9)62/h19-22,29-34,37-42,44-46,62-63H,14-18,23-28H2,1-13H3,(H,55,67)(H,56,66)(H,57,65)/t32-,33+,34-,37+,38+,39+,40-,41+,42+,44-,45+,46+/m1/s1
InChIKey OSGNLULODCTKKR-FSTQGQPNSA-N
Mol Weight 1056.3 g/mol
Molecular Formula C54H85N7O14
Exact Mass 1055.61545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWAKTI1keiv
Name TAMANDARIN-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H85N7O14
InChI InChI=1S/C54H85N7O14/c1-14-32(8)44-42(63)28-43(64)75-46(31(6)7)49(67)55-37(25-29(2)3)51(69)61-24-16-18-39(61)53(71)59(12)41(27-35-19-21-36(73-13)22-20-35)54(72)74-34(10)45(48(66)56-44)57-47(65)40(26-30(4)5)58(11)52(70)38-17-15-23-60(38)50(68)33(9)62/h19-22,29-34,37-42,44-46,62-63H,14-18,23-28H2,1-13H3,(H,55,67)(H,56,66)(H,57,65)/t32-,33+,34-,37+,38+,39+,40-,41+,42+,44-,45+,46+/m1/s1
InChIKey OSGNLULODCTKKR-FSTQGQPNSA-N
Literature Reference Author B.LIANG,P.PORTONOVO,M.D.VERA,D.XIAO,M.M.JOULLIE
Literature Reference Citation ORG.LETTERS,1,1319(1999)
Literature Reference DOI 10.1021/ol9910058
Molecular Weight 1056.307 g/mol
Solvent CDCl3
Source File Reference UWSI26475