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YM-47141
SpectraBase Compound ID Lh5yHMk77QC
InChI InChI=1S/C46H64N8O14/c1-23(2)18-30-38(58)46(66,67)45(65)52-31(19-24(3)4)40(60)51-33(22-34(47)56)39(59)48-25(5)44(64)68-27(7)37(43(63)50-30)54-42(62)36(26(6)55)53-41(61)32(20-28-14-10-8-11-15-28)49-35(57)21-29-16-12-9-13-17-29/h8-17,23-27,30-33,36-37,55,66-67H,18-22H2,1-7H3,(H2,47,56)(H,48,59)(H,49,57)(H,50,63)(H,51,60)(H,52,65)(H,53,61)(H,54,62)/t25-,26?,27?,30?,31-,32-,33-,36+,37-/m1/s1
InChIKey SHQCPEANUMMPNP-XUBGFTKHSA-N
Mol Weight 953.1 g/mol
Molecular Formula C46H64N8O14
Exact Mass 952.454199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CfhbUq2nsqD
Name YM-47141
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H64N8O14
InChI InChI=1S/C46H64N8O14/c1-23(2)18-30-38(58)46(66,67)45(65)52-31(19-24(3)4)40(60)51-33(22-34(47)56)39(59)48-25(5)44(64)68-27(7)37(43(63)50-30)54-42(62)36(26(6)55)53-41(61)32(20-28-14-10-8-11-15-28)49-35(57)21-29-16-12-9-13-17-29/h8-17,23-27,30-33,36-37,55,66-67H,18-22H2,1-7H3,(H2,47,56)(H,48,59)(H,49,57)(H,50,63)(H,51,60)(H,52,65)(H,53,61)(H,54,62)/t25-,26?,27?,30?,31-,32-,33-,36+,37-/m1/s1
InChIKey SHQCPEANUMMPNP-XUBGFTKHSA-N
Literature Reference Author M.ORITA,K.YASUMURO,K.KOKUBO,M.SHIMIZU,K.ABE,T.TOKUNAGA,H.KAN IWA
Literature Reference Citation J.ANTIBIOTICS,48,1430(1995)
Literature Reference DOI 10.7164/antibiotics.48.1430
Molecular Weight 953.059 g/mol
Solvent DMSO-D6
Source File Reference UWCP8830