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3-DE-(2-METHYLBUTANOYL)-3-PROPANOYL-CIPADESIN
SpectraBase Compound ID F1FRjXVmmJG
InChI InChI=1S/C30H38O8/c1-7-22(31)37-27-18-12-17-19(30(5,25(18)34)21(28(27,2)3)14-23(32)35-6)8-10-29(4)20(17)13-24(33)38-26(29)16-9-11-36-15-16/h9,11-12,15,18-21,26-27H,7-8,10,13-14H2,1-6H3/t18-,19+,20+,21+,26+,27-,29-,30-/m1/s1
InChIKey ZICTXYZNYKUBSX-JMUMQBTOSA-N
Mol Weight 526.6 g/mol
Molecular Formula C30H38O8
Exact Mass 526.256668 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7r0XgatrgEj
Name 3-DE-(2-METHYLBUTANOYL)-3-PROPANOYL-CIPADESIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O8
InChI InChI=1S/C30H38O8/c1-7-22(31)37-27-18-12-17-19(30(5,25(18)34)21(28(27,2)3)14-23(32)35-6)8-10-29(4)20(17)13-24(33)38-26(29)16-9-11-36-15-16/h9,11-12,15,18-21,26-27H,7-8,10,13-14H2,1-6H3/t18-,19+,20+,21+,26+,27-,29-,30-/m1/s1
InChIKey ZICTXYZNYKUBSX-JMUMQBTOSA-N
Literature Reference Author X.Y.WANG,C.M.YUAN,G.H.TANG,T.ZOU,F.GUO,J.H.LIAO,H.Y.ZHANG,G. Y.ZUO,G.X.RAO,H.P.HE
Literature Reference Citation J.AS.NAT.PROD.RES.,16,795(2014)
Literature Reference DOI 10.1080/10286020.2014.920011
Molecular Weight 526.627 g/mol
Solvent CDCl3
Source File Reference UWPA9220