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CERTONARDOSTEROL-A3;(25S)-5-ALPHA-CHOLESTANE-3-BETA,4-BETA,6-ALPHA,8,15-BETA,26-HEXOL
SpectraBase Compound ID 7mRZt69M54m
InChI InChI=1S/C27H48O6/c1-15(14-28)6-5-7-16(2)17-12-19(30)24-25(17,3)11-9-21-26(4)10-8-18(29)23(32)22(26)20(31)13-27(21,24)33/h15-24,28-33H,5-14H2,1-4H3/t15-,16-,17?,18+,19-,20+,21?,22?,23+,24?,25-,26-,27+/m1/s1
InChIKey MTSTUXPJLVKFMK-BAKPELITSA-N
Mol Weight 468.7 g/mol
Molecular Formula C27H48O6
Exact Mass 468.345089 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LJQeaMLZ4Ei
Name CERTONARDOSTEROL-A3;(25S)-5-ALPHA-CHOLESTANE-3-BETA,4-BETA,6-ALPHA,8,15-BETA,26-HEXOL
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H48O6
InChI InChI=1S/C27H48O6/c1-15(14-28)6-5-7-16(2)17-12-19(30)24-25(17,3)11-9-21-26(4)10-8-18(29)23(32)22(26)20(31)13-27(21,24)33/h15-24,28-33H,5-14H2,1-4H3/t15-,16-,17?,18+,19-,20+,21?,22?,23+,24?,25-,26-,27+/m1/s1
InChIKey MTSTUXPJLVKFMK-BAKPELITSA-N
Literature Reference Author W.WANG,H.JANG,J.HONG,C.O.LEE,K.S.IM,S.J.BAE,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,67,1654(2004)
Literature Reference DOI 10.1021/np049869b
Molecular Weight 468.675 g/mol
Solvent C5D5N:CD3OD
Source File Reference UWMZ6511