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COSMOMYCIN-D;COS-D
SpectraBase Compound ID CauYrw0fuVw
InChI InChI=1S/C60H88N2O22/c1-12-60(72)24-39(79-42-20-32(61(8)9)55(27(4)75-42)82-44-22-37(66)57(29(6)77-44)80-40-18-16-34(63)25(2)73-40)47-50(54(71)48-49(53(47)70)52(69)46-31(51(48)68)14-13-15-36(46)65)59(60)84-43-21-33(62(10)11)56(28(5)76-43)83-45-23-38(67)58(30(7)78-45)81-41-19-17-35(64)26(3)74-41/h13-15,25-30,32-35,37-45,55-59,63-67,70-72H,12,16-24H2,1-11H3/t25-,26-,27-,28+,29+,30-,32-,33+,34-,35-,37+,38-,39+,40-,41-,42-,43+,44+,45-,55+,56-,57-,58+,59-,60+/m1/s1
InChIKey DKWBRHNUUTWKAG-OLBLZRHWSA-N
Mol Weight 1189.4 g/mol
Molecular Formula C60H88N2O22
Exact Mass 1188.582872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BoncNjqxa5p
Name COSMOMYCIN-D;COS-D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H88N2O22
InChI InChI=1S/C60H88N2O22/c1-12-60(72)24-39(79-42-20-32(61(8)9)55(27(4)75-42)82-44-22-37(66)57(29(6)77-44)80-40-18-16-34(63)25(2)73-40)47-50(54(71)48-49(53(47)70)52(69)46-31(51(48)68)14-13-15-36(46)65)59(60)84-43-21-33(62(10)11)56(28(5)76-43)83-45-23-38(67)58(30(7)78-45)81-41-19-17-35(64)26(3)74-41/h13-15,25-30,32-35,37-45,55-59,63-67,70-72H,12,16-24H2,1-11H3/t25-,26-,27-,28+,29+,30-,32-,33+,34-,35-,37+,38-,39+,40-,41-,42-,43+,44+,45-,55+,56-,57-,58+,59-,60+/m1/s1
InChIKey DKWBRHNUUTWKAG-OLBLZRHWSA-N
Literature Reference Author R.L.A.FURALN,S.J.WATT,L.M.GARRIDO,G.P.AMARANTE-MENDES,M.NUR- E-ALAM,J.ROHR,A.BRAN
Literature Reference Citation J.ANTIBIOTICS,57,647(2004)
Literature Reference DOI 10.7164/antibiotics.57.647
Molecular Weight 1189.359 g/mol
Sample ID 65794
Solvent CD2Cl2