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4,5-DIACETOXY-OCTA-2,6-DIENOIC-ACID-3-ACETOXY-2-ACETOXYMETHYL-3-METHOXYCARBONYL-PROPYLESTER;MUSACIN-C-TETRAACETATE
SpectraBase Compound ID 4Gdh0Vl6wb5
InChI InChI=1S/C22H30O12/c1-7-8-18(32-14(3)24)19(33-15(4)25)9-10-20(27)31-12-17(11-30-13(2)23)21(22(28)29-6)34-16(5)26/h7-10,17-19,21H,11-12H2,1-6H3/b8-7+,10-9+
InChIKey IRWKELDGICUWIR-XBLVEGMJSA-N
Mol Weight 486.47 g/mol
Molecular Formula C22H30O12
Exact Mass 486.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID gBKr69DPwr
Name 4,5-DIACETOXY-OCTA-2,6-DIENOIC-ACID-3-ACETOXY-2-ACETOXYMETHYL-3-METHOXYCARBONYL-PROPYLESTER;MUSACIN-C-TETRAACETATE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30O12
InChI InChI=1S/C22H30O12/c1-7-8-18(32-14(3)24)19(33-15(4)25)9-10-20(27)31-12-17(11-30-13(2)23)21(22(28)29-6)34-16(5)26/h7-10,17-19,21H,11-12H2,1-6H3/b8-7+,10-9+
InChIKey IRWKELDGICUWIR-XBLVEGMJSA-N
Literature Reference Author A.SCHNEIDER,J.SPAETH,S.BREIDING-MACK,A.ZEECK,S.GRABLEY,R.THI ERICKE
Literature Reference Citation J.ANTIBIOTICS,49,438(1996)
Literature Reference DOI 10.7164/antibiotics.49.438
Molecular Weight 486.473 g/mol
Solvent CDCl3
Source File Reference UWGE1932