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AXINYSTEROL
SpectraBase Compound ID 1LG65D8tybA
InChI InChI=1S/C28H42O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,19-24,29H,1,9-14,17H2,2-6H3/b8-7+/t19-,20-,21+,22-,23-,24-,25-,26-,27-,28+/m1/s1
InChIKey MSFASZXZLNRTBR-LBMRXTFASA-N
Mol Weight 426.6 g/mol
Molecular Formula C28H42O3
Exact Mass 426.313395 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KssWFnZpPrX
Name AXINYSTEROL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H42O3
InChI InChI=1S/C28H42O3/c1-18(2)19(3)7-8-20(4)22-9-10-23-25(22,5)13-12-24-26(6)14-11-21(29)17-27(26)15-16-28(23,24)31-30-27/h7-8,15-16,19-24,29H,1,9-14,17H2,2-6H3/b8-7+/t19-,20-,21+,22-,23-,24-,25-,26-,27-,28+/m1/s1
InChIKey MSFASZXZLNRTBR-LBMRXTFASA-N
Literature Reference Author M.IWASHIMA,I.TERADA,K.IGUCHI,T.YAMORI
Literature Reference Citation CHEM.PHARM.BULL.,50,1286(2002)
Literature Reference DOI 10.1248/cpb.50.1286
Molecular Weight 426.640 g/mol
Solvent CDCl3
Source File Reference UWMS20028