John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5ZhGrIVAtVE SpectraBase Spectrum ID=2uyQF2QahXz

(accessed ).
PAMVLGJISQIGDS-CKEVAOJHSA-N
SpectraBase Compound ID 5ZhGrIVAtVE
InChI InChI=1S/C51H66O8/c1-48(2)25-16-26-49(3)43(48)23-27-50(4)44(49)24-28-51(5,59-36-56-33-39-21-14-9-15-22-39)47(50)45(52)41-29-40(57-34-54-31-37-17-10-7-11-18-37)30-42(53-6)46(41)58-35-55-32-38-19-12-8-13-20-38/h7-15,17-22,29-30,43-45,47,52H,16,23-28,31-36H2,1-6H3/t43?,44?,45?,47-,49-,50+,51-/m0/s1
InChIKey PAMVLGJISQIGDS-CKEVAOJHSA-N
Mol Weight 807.1 g/mol
Molecular Formula C51H66O8
Exact Mass 806.47577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2uyQF2QahXz
Name PAMVLGJISQIGDS-CKEVAOJHSA-N
Compound Number 18B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H66O8
InChI InChI=1S/C51H66O8/c1-48(2)25-16-26-49(3)43(48)23-27-50(4)44(49)24-28-51(5,59-36-56-33-39-21-14-9-15-22-39)47(50)45(52)41-29-40(57-34-54-31-37-17-10-7-11-18-37)30-42(53-6)46(41)58-35-55-32-38-19-12-8-13-20-38/h7-15,17-22,29-30,43-45,47,52H,16,23-28,31-36H2,1-6H3/t43?,44?,45?,47-,49-,50+,51-/m0/s1
InChIKey PAMVLGJISQIGDS-CKEVAOJHSA-N
Literature Reference Author K.WARABI,B.O.PATRICK,P.AUSTIN,C.D.ROSKELLY,M.ROBERGE,R.J.AND ERSEN
Literature Reference Citation J.NAT.PROD.,70,736(2007)
Literature Reference DOI 10.1021/np060481l
Molecular Weight 807.080 g/mol
Sample ID 30214
Solvent C6D6
SpectraBase Batch ID KVQXq1b7AC2