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SODIUM-3-ALPHA-HYDROXY-3,5-DIHYDRO-ML-236C
SpectraBase Compound ID 78qbzW8EaUl
InChI InChI=1S/C18H30O5.Na/c1-11-15(7-6-13(19)9-14(20)10-18(22)23)16-5-3-2-4-12(16)8-17(11)21;/h8,11,13-17,19-21H,2-7,9-10H2,1H3,(H,22,23);/q;+1/p-1/t11-,13+,14-,15+,16+,17-;/m1./s1
InChIKey XBTWFFUSHWXAQH-YEVHXPGNSA-M
Mol Weight 348.41 g/mol
Molecular Formula C18H29NaO5
Exact Mass 348.191268 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Sg39ZDXYOo
Name SODIUM-3-ALPHA-HYDROXY-3,5-DIHYDRO-ML-236C
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H29NaO5
InChI InChI=1S/C18H30O5.Na/c1-11-15(7-6-13(19)9-14(20)10-18(22)23)16-5-3-2-4-12(16)8-17(11)21;/h8,11,13-17,19-21H,2-7,9-10H2,1H3,(H,22,23);/q;+1/p-1/t11-,13+,14-,15+,16+,17-;/m1./s1
InChIKey XBTWFFUSHWXAQH-YEVHXPGNSA-M
Literature Reference Author S.MURAKAWA,K.SAKAI,A.ENDO
Literature Reference Citation J.ANTIBIOTICS,47,108(1994)
Literature Reference DOI 10.7164/antibiotics.47.108
Molecular Weight 348.415 g/mol
Sample ID 53444
Solvent CD3OD