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PQDUHXLDRQOSDU-UHFFFAOYSA-N

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PQDUHXLDRQOSDU-UHFFFAOYSA-N
SpectraBase Compound ID ANUgEkkvNPx
InChI InChI=1S/C53H82O19/c1-9-10-12-25-48(67-36(3)55)33-52(71-40(7)59)31-46(65)23-16-21-44(63)29-50(69-38(5)57)27-42(61)19-13-11-14-26-49(68-37(4)56)34-53(72-41(8)60)32-47(66)24-17-22-45(64)30-51(70-39(6)58)28-43(62)20-15-18-35(2)54/h48-53H,9-34H2,1-8H3
InChIKey PQDUHXLDRQOSDU-UHFFFAOYSA-N
Mol Weight 1023.2 g/mol
Molecular Formula C53H82O19
Exact Mass 1022.54503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID fHvpk7WG26
Name PQDUHXLDRQOSDU-UHFFFAOYSA-N
Compound Number ACETATE-#II
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C53H82O19
InChI InChI=1S/C53H82O19/c1-9-10-12-25-48(67-36(3)55)33-52(71-40(7)59)31-46(65)23-16-21-44(63)29-50(69-38(5)57)27-42(61)19-13-11-14-26-49(68-37(4)56)34-53(72-41(8)60)32-47(66)24-17-22-45(64)30-51(70-39(6)58)28-43(62)20-15-18-35(2)54/h48-53H,9-34H2,1-8H3
InChIKey PQDUHXLDRQOSDU-UHFFFAOYSA-N
Literature Reference Author Y.KONO,S.TAKEUCHI,A.KAWARADA,J.M.DALY,H.W.KNOCHE
Literature Reference Citation AGR.BIOL.CHEM.,44,2613(1980)
Literature Reference DOI 10.1271/bbb1961.44.2613
Molecular Weight 1023.223 g/mol
Solvent CDCl3
Source File Reference UWBT8546