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ONAVIVJNJJFDMN-UCRAQODLSA-N
SpectraBase Compound ID D1aoyEMGXOG
InChI InChI=1S/C56H71N7O11/c1-33(2)44-49(66)59-45(34(3)4)50(67)61-47(37(7)74-55(8,9)10)51(68)58-42(31-43(64)63-56(39-25-17-12-18-26-39,40-27-19-13-20-28-40)41-29-21-14-22-30-41)48(65)57-35(5)53(70)73-36(6)46(52(69)60-44)62-54(71)72-32-38-23-15-11-16-24-38/h11-30,33-37,42,44-47H,31-32H2,1-10H3,(H,57,65)(H,58,68)(H,59,66)(H,60,69)(H,61,67)(H,62,71)(H,63,64)/t35-,36+,37-,42-,44-,45+,46-,47-/m1/s1
InChIKey ONAVIVJNJJFDMN-UCRAQODLSA-N
Mol Weight 1018.2 g/mol
Molecular Formula C56H71N7O11
Exact Mass 1017.521156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LvBTlAVucyn
Name ONAVIVJNJJFDMN-UCRAQODLSA-N
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H71N7O11
InChI InChI=1S/C56H71N7O11/c1-33(2)44-49(66)59-45(34(3)4)50(67)61-47(37(7)74-55(8,9)10)51(68)58-42(31-43(64)63-56(39-25-17-12-18-26-39,40-27-19-13-20-28-40)41-29-21-14-22-30-41)48(65)57-35(5)53(70)73-36(6)46(52(69)60-44)62-54(71)72-32-38-23-15-11-16-24-38/h11-30,33-37,42,44-47H,31-32H2,1-10H3,(H,57,65)(H,58,68)(H,59,66)(H,60,69)(H,61,67)(H,62,71)(H,63,64)/t35-,36+,37-,42-,44-,45+,46-,47-/m1/s1
InChIKey ONAVIVJNJJFDMN-UCRAQODLSA-N
Literature Reference Author J.R.COCHRANE,D.H.YOON,C.S.P.MCERLEAN,K.A.JOLLIFFE
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1344(2012)
Literature Reference DOI 10.3762/bjoc.8.154
Molecular Weight 1018.220 g/mol
Solvent DMSO-D6
Source File Reference UWIR11039