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7-BETA,20,23-XI-TRIHYDROXY-3,11,15-TRIOXOLANOSTA-8-EN-26-OIC-ACID
SpectraBase Compound ID KSUOXsw7hwr
InChI InChI=1S/C30H44O8/c1-15(25(36)37)10-16(31)13-29(6,38)20-12-22(35)30(7)24-17(32)11-19-26(2,3)21(34)8-9-27(19,4)23(24)18(33)14-28(20,30)5/h15-17,19-20,31-32,38H,8-14H2,1-7H3,(H,36,37)/t15?,16?,17-,19-,20-,27-,28+,29?,30-/m0/s1
InChIKey XMBMRJGNNOUNJL-MWCSVCPUSA-N
Mol Weight 532.7 g/mol
Molecular Formula C30H44O8
Exact Mass 532.303618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bw9tpni9OIj
Name 7-BETA,20,23-XI-TRIHYDROXY-3,11,15-TRIOXOLANOSTA-8-EN-26-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44O8
InChI InChI=1S/C30H44O8/c1-15(25(36)37)10-16(31)13-29(6,38)20-12-22(35)30(7)24-17(32)11-19-26(2,3)21(34)8-9-27(19,4)23(24)18(33)14-28(20,30)5/h15-17,19-20,31-32,38H,8-14H2,1-7H3,(H,36,37)/t15?,16?,17-,19-,20-,27-,28+,29?,30-/m0/s1
InChIKey XMBMRJGNNOUNJL-MWCSVCPUSA-N
Literature Reference Author S.H.SHIM,J.RYU,J.S.KIM,S.S.KANG,Y.XU,S.H.JUNG,Y.S.LEE,S.LEE, K.H.SHIN
Literature Reference Citation J.NAT.PROD.,67,1110(2004)
Literature Reference DOI 10.1021/np030383p
Molecular Weight 532.675 g/mol
Solvent CDCl3
Source File Reference UWMZ5540