SpectraBase Compound ID | FT53PjFiK7c |
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InChI | InChI=1S/C38H59NO8S/c1-7-8-9-10-12-15-28(3)24-32-25-29(4)16-13-11-14-17-36(47-48(43,44)33-21-18-27(2)19-22-33)35(46-38(39)42)23-20-30(5)26-34(40)31(6)37(41)45-32/h11-13,15,18-19,21-22,24,29-32,34-36,40H,7-10,14,16-17,20,23,25-26H2,1-6H3,(H2,39,42)/b13-11+,15-12+,28-24+/t29-,30+,31-,32-,34-,35+,36+/m1/s1 |
InChIKey | YNAMSKJDUUTJOA-VKWPLEPISA-N |
Mol Weight | 689.9 g/mol |
Molecular Formula | C38H59NO8S |
Exact Mass | 689.396139 g/mol |
SpectraBase Spectrum ID | 6Pvg2Nxn9xN |
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Name | YNAMSKJDUUTJOA-VKWPLEPISA-N |
Compound Number | 27 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C38H59NO8S |
InChI | InChI=1S/C38H59NO8S/c1-7-8-9-10-12-15-28(3)24-32-25-29(4)16-13-11-14-17-36(47-48(43,44)33-21-18-27(2)19-22-33)35(46-38(39)42)23-20-30(5)26-34(40)31(6)37(41)45-32/h11-13,15,18-19,21-22,24,29-32,34-36,40H,7-10,14,16-17,20,23,25-26H2,1-6H3,(H2,39,42)/b13-11+,15-12+,28-24+/t29-,30+,31-,32-,34-,35+,36+/m1/s1 |
InChIKey | YNAMSKJDUUTJOA-VKWPLEPISA-N |
Literature Reference Author | L.G.ZAR,A.BISHARA,M.AKNIN,D.NEUMANN,N.BEN-CALIFA,Y.KASHMAN |
Literature Reference Citation | MAR.DRUGS,11,4487(2013) |
Literature Reference DOI | 10.3390/md11114487 |
Molecular Weight | 689.948 g/mol |
Source File Reference | UWBT6626 |