SpectraBase Compound ID | IomDciuVDFu |
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InChI | InChI=1S/C30H48O9S2/c1-19(2)15-21(31)16-20(3)22-9-11-28(6)24-8-7-23-26(4,18-38-40(32,33)34)25(39-41(35,36)37)10-12-29(23)17-30(24,29)14-13-27(22,28)5/h15,20,22-25H,7-14,16-18H2,1-6H3,(H,32,33,34)(H,35,36,37)/t20-,22-,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1 |
InChIKey | GQPWURSJMXLUAW-PAEBMLBLSA-N |
Mol Weight | 616.8 g/mol |
Molecular Formula | C30H48O9S2 |
Exact Mass | 616.273975 g/mol |
SpectraBase Spectrum ID | HRHt4jQbbYb |
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Name | GQPWURSJMXLUAW-PAEBMLBLSA-N |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H48O9S2 |
InChI | InChI=1S/C30H48O9S2/c1-19(2)15-21(31)16-20(3)22-9-11-28(6)24-8-7-23-26(4,18-38-40(32,33)34)25(39-41(35,36)37)10-12-29(23)17-30(24,29)14-13-27(22,28)5/h15,20,22-25H,7-14,16-18H2,1-6H3,(H,32,33,34)(H,35,36,37)/t20-,22-,23+,24+,25+,26+,27-,28+,29-,30+/m1/s1 |
InChIKey | GQPWURSJMXLUAW-PAEBMLBLSA-N |
Literature Reference Author | J.A.CLEMENT,B.N.ZHOU,R.K.JOHNSON,D.G.I.KINGSTON |
Literature Reference Citation | MAGN.RES.CHEM.,41,644(2003) |
Literature Reference DOI | 10.1002/mrc.1228 |
Molecular Weight | 616.826 g/mol |
Solvent | CD3OD |
Source File Reference | UWMZ19844 |