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ILEKUDINOL-B;2-ALPHA,3-BETA-DIHYDROXY-24-NOR-URS-4(23),12-DIEN-28-OIC-ACID
SpectraBase Compound ID 1eJoKmNAg3K
InChI InChI=1S/C29H44O4/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)/t16-,17+,19+,21-,22-,23+,24-,26+,27-,28-,29+/m1/s1
InChIKey RDOIACMZJPLQIZ-FNVOJQHCSA-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 FKWSOhkNc4
Name ILEKUDINOL-B;2-ALPHA,3-BETA-DIHYDROXY-24-NOR-URS-4(23),12-DIEN-28-OIC-ACID
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/c1-16-9-12-29(25(32)33)14-13-27(5)20(23(29)17(16)2)7-8-22-26(4)15-21(30)24(31)18(3)19(26)10-11-28(22,27)6/h7,16-17,19,21-24,30-31H,3,8-15H2,1-2,4-6H3,(H,32,33)/t16-,17+,19+,21-,22-,23+,24-,26+,27-,28-,29+/m1/s1
InChIKey RDOIACMZJPLQIZ-FNVOJQHCSA-N
Literature Reference Author K.NISHIMURA,T.FUKUDA,T.MIYASE,H.NOGUCHI,X.M.CHEN
Literature Reference Citation J.NAT.PROD.,62,1061(1999)
Literature Reference DOI 10.1021/np990019j
Molecular Weight 456.666 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCP8670