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HYTRAMYCIN_I;(1-S,8-R,11-S,18-R,21-S,24-R)-10,11-DIMETHYL-21-(2-METHYLPROPYL)-24-[(S)-1-METHYLPROPYL]-3,4,10,13,14,20,23,26,27-NONAZA

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HYTRAMYCIN_I;(1-S,8-R,11-S,18-R,21-S,24-R)-10,11-DIMETHYL-21-(2-METHYLPROPYL)-24-[(S)-1-METHYLPROPYL]-3,4,10,13,14,20,23,26,27-NONAZA
SpectraBase Compound ID GpEa5E72tqr
InChI InChI=1S/C31H53N9O6/c1-7-19(4)25-31(46)40-24(13-10-16-34-40)30(45)39-23(12-9-15-33-39)29(44)37(6)20(5)28(43)38-22(11-8-14-32-38)27(42)35-21(17-18(2)3)26(41)36-25/h18-25,32-34H,7-17H2,1-6H3,(H,35,42)(H,36,41)/t19-,20+,21+,22+,23-,24-,25+/m1/s1
InChIKey AHVYNRPQGLJIJS-YFRUONAMSA-N
Mol Weight 647.8 g/mol
Molecular Formula C31H53N9O6
Exact Mass 647.41188 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 43R65TFGm4M
Name HYTRAMYCIN_I;(1-S,8-R,11-S,18-R,21-S,24-R)-10,11-DIMETHYL-21-(2-METHYLPROPYL)-24-[(S)-1-METHYLPROPYL]-3,4,10,13,14,20,23,26,27-NONAZA
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H53N9O6
InChI InChI=1S/C31H53N9O6/c1-7-19(4)25-31(46)40-24(13-10-16-34-40)30(45)39-23(12-9-15-33-39)29(44)37(6)20(5)28(43)38-22(11-8-14-32-38)27(42)35-21(17-18(2)3)26(41)36-25/h18-25,32-34H,7-17H2,1-6H3,(H,35,42)(H,36,41)/t19-,20+,21+,22+,23-,24-,25+/m1/s1
InChIKey AHVYNRPQGLJIJS-YFRUONAMSA-N
Literature Reference Author G.CAI,J.G.NAPOLITANO,J.B.MCALPINE,Y.WANG,B.U.JAKI,J.W.SUH,S. H.YANG,I.A.LEE,S.G.F
Literature Reference Citation J.NAT.PROD.,76,2009(2013)
Literature Reference DOI 10.1021/np400145u
Molecular Weight 647.819 g/mol
Solvent CD3OD
Source File Reference UWMZ43386