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(-)-(1-R,2-S,7-R,8-R,3-E,11-E)-8-CHLORO-2,18-DIACETOXYCEMBRA-3,11,15-(17)-TRIEN-7-OL
SpectraBase Compound ID Jik7o4Nob4T
InChI InChI=1S/C24H37ClO5/c1-16(2)21-11-9-17(3)8-7-13-24(6,25)23(28)12-10-20(15-29-18(4)26)14-22(21)30-19(5)27/h8,14,21-23,28H,1,7,9-13,15H2,2-6H3/b17-8+,20-14+/t21-,22+,23-,24-/m1/s1
InChIKey UAHZWYSHSHABFU-DXWMHCCVSA-N
Mol Weight 441.0 g/mol
Molecular Formula C24H37ClO5
Exact Mass 440.232952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DYxyZscWxyJ
Name (-)-(1-R,2-S,7-R,8-R,3-E,11-E)-8-CHLORO-2,18-DIACETOXYCEMBRA-3,11,15-(17)-TRIEN-7-OL
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H37ClO5
InChI InChI=1S/C24H37ClO5/c1-16(2)21-11-9-17(3)8-7-13-24(6,25)23(28)12-10-20(15-29-18(4)26)14-22(21)30-19(5)27/h8,14,21-23,28H,1,7,9-13,15H2,2-6H3/b17-8+,20-14+/t21-,22+,23-,24-/m1/s1
InChIKey UAHZWYSHSHABFU-DXWMHCCVSA-N
Literature Reference Author E.TELLO,L.CASTELLANOS,C.AREVALO-FERRO,C.DUQUE
Literature Reference Citation J.NAT.PROD.,72,1595(2009)
Literature Reference DOI 10.1021/np9002492
Molecular Weight 441.008 g/mol
Sample ID 33491
Solvent CDCl3