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30-HYDROXYMYCALOLIDE-A;MAJOR-ISOMER
SpectraBase Compound ID 3RhTWurJoLs
InChI InChI=1S/C47H66N4O14/c1-27(17-18-38(56)29(3)44(64-32(6)53)28(2)19-20-51(7)26-52)40(59-9)22-41-31(5)39(58-8)15-12-16-42-48-35(24-61-42)46-50-36(25-63-46)47-49-34(23-62-47)45(60-10)30(4)37(55)14-11-13-33(54)21-43(57)65-41/h11-12,14,16,19-20,23-31,33,38-41,44-45,54,56H,13,15,17-18,21-22H2,1-10H3/b14-11-,16-12-,20-19+
InChIKey RJGURWXRVVOFCD-FYPMHXRPSA-N
Mol Weight 911.1 g/mol
Molecular Formula C47H66N4O14
Exact Mass 910.457553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6HndozBKpTy
Name 30-HYDROXYMYCALOLIDE-A;MINOR-ISOMER
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C47H66N4O14
InChI InChI=1S/C47H66N4O14/c1-27(17-18-38(56)29(3)44(64-32(6)53)28(2)19-20-51(7)26-52)40(59-9)22-41-31(5)39(58-8)15-12-16-42-48-35(24-61-42)46-50-36(25-63-46)47-49-34(23-62-47)45(60-10)30(4)37(55)14-11-13-33(54)21-43(57)65-41/h11-12,14,16,19-20,23-31,33,38-41,44-45,54,56H,13,15,17-18,21-22H2,1-10H3/b14-11-,16-12-,20-19+
InChIKey RJGURWXRVVOFCD-FYPMHXRPSA-N
Literature Reference Author S.MATSUNAGA,T.SUGAWARA,N.FUSETANI
Literature Reference Citation J.NAT.PROD.,61,1164(1998)
Literature Reference DOI 10.1021/np980102r
Molecular Weight 911.059 g/mol
Solvent CD3OD
Source File Reference UWCP2159