SpectraBase Compound ID | KFKARgEmZjT |
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InChI | InChI=1S/C19H24O4S/c1-18-11-16(20)14-10-19(18,21)23-17(22-18)15(14)12-24-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,14-15,17,21H,5,8-12H2,1H3/t14-,15+,17+,18+,19-/m1/s1 |
InChIKey | KGLHLWNMMZGUQQ-ZDMKNRLGSA-N |
Mol Weight | 348.46 g/mol |
Molecular Formula | C19H24O4S |
Exact Mass | 348.13953 g/mol |
SpectraBase Spectrum ID | 19LgYYf9g9m |
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Name | 7S-PPT-PM-I (8-phenylpropylthiopaeonimetabolin-I) |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C19H24O4S |
InChI | InChI=1S/C19H24O4S/c1-18-11-16(20)14-10-19(18,21)23-17(22-18)15(14)12-24-9-5-8-13-6-3-2-4-7-13/h2-4,6-7,14-15,17,21H,5,8-12H2,1H3/t14-,15+,17+,18+,19-/m1/s1 |
InChIKey | KGLHLWNMMZGUQQ-ZDMKNRLGSA-N |
Molecular Weight | 348.457 g/mol |
SMILES | O[C@]12[C@]3(O[C@@](O2)([C@](CSCCCc2ccccc2)([H])[C@@](C1)(C(=O)C3)[H])[H])C |
SPLASH | splash10-014i-5900000000-9f56e3bf06cdd8b638ff |
Source of Spectrum | E2-50-1234-4 |
Wiley ID | 1555905 |