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LEUCASTRIN-A;(3-S,17-S,20-S,24-S)-3,20-DIHYDROXY-24-METHYLPROTOST-25-ENE

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LEUCASTRIN-A;(3-S,17-S,20-S,24-S)-3,20-DIHYDROXY-24-METHYLPROTOST-25-ENE
SpectraBase Compound ID 6tAepKuK1HR
InChI InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h21-26,32-33H,1,10-19H2,2-9H3/t21-,22-,23-,24-,25-,26-,28-,29-,30-,31-/m0/s1
InChIKey BPDZJMCTHRVRNC-UFBXBFJDSA-N
Mol Weight 458.8 g/mol
Molecular Formula C31H54O2
Exact Mass 458.412381 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ls4kBkhEc6r
Name LEUCASTRIN-A;(3-S,17-S,20-S,24-S)-3,20-DIHYDROXY-24-METHYLPROTOST-25-ENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H54O2
InChI InChI=1S/C31H54O2/c1-20(2)21(3)12-19-31(9,33)23-13-17-29(7)22(23)10-11-25-28(6)16-15-26(32)27(4,5)24(28)14-18-30(25,29)8/h21-26,32-33H,1,10-19H2,2-9H3/t21-,22-,23-,24-,25-,26-,28-,29-,30-,31-/m0/s1
InChIKey BPDZJMCTHRVRNC-UFBXBFJDSA-N
Literature Reference Author Y.MIYAICHI,A.SEGAWA,T.TOMIMORI
Literature Reference Citation CHEM.PHARM.BULL.,54,1370(2006)
Literature Reference DOI 10.1248/cpb.54.1370
Molecular Weight 458.769 g/mol
Sample ID 37320
Solvent CDCl3