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NORSELIC_ACID_B
SpectraBase Compound ID K7kGg1zt3cJ
InChI InChI=1S/C29H44O4/c1-6-28(33,18(2)3)15-11-19(4)23-9-10-25-22-8-7-20-17-21(30)12-14-27(20,5)24(22)13-16-29(23,25)26(31)32/h12,14,19-20,22-25,33H,2,6-11,13,15-17H2,1,3-5H3,(H,31,32)/t19-,20?,22-,23-,24+,25+,27+,28-,29+/m1/s1
InChIKey KTOLWQCZNYCQTO-MOKVIODPSA-N
Mol Weight 456.7 g/mol
Molecular Formula C29H44O4
Exact Mass 456.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G7E3GrRnY3t
Name NORSELIC_ACID_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H44O4
InChI InChI=1S/C29H44O4/c1-6-28(33,18(2)3)15-11-19(4)23-9-10-25-22-8-7-20-17-21(30)12-14-27(20,5)24(22)13-16-29(23,25)26(31)32/h12,14,19-20,22-25,33H,2,6-11,13,15-17H2,1,3-5H3,(H,31,32)/t19-,20?,22-,23-,24+,25+,27+,28-,29+/m1/s1
InChIKey KTOLWQCZNYCQTO-MOKVIODPSA-N
Literature Reference Author W.S.MA,T.MUTKA,B.VESLEY,M.O.AMSLER,J.B.MCCLINTOCK,C.D.AMSLER ,J.A.PERMAN,M.P.SING
Literature Reference Citation J.NAT.PROD.,72,1842(2009)
Literature Reference DOI 10.1021/np900382x
Molecular Weight 456.666 g/mol
Sample ID 33721
Solvent CDCl3