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Valnemulin hydrochloride

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For Research Use Only | Not For Clinical Use
CATAPS133868469
CAS133868-46-9
Structure
SynonymsValnemulin hydrochloride, (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-Ethenyl-5-hydroxy-4,6,9,10-tetramethyl-1-oxodecahydro-3a,9-propano-3aH-cyclopenta[8]annulen-8-yl [[2-[[(2R)-2-amino-3-methylbutanoyl]amino]-1,1-dimethylethyl]sulfanyl]acetate hydrochloride
IUPAC Name(3aS,4R,5S,6S,8R,9R,9aR,10R)-6-Ethenyl-5-hydroxy-4,6,9,10-tetramethyl-1-oxodecahydro-3a,9-propano-3aH-cyclopenta[8]annulen-8-yl [[2-[[(2R)-2-amino-3-methylbutanoyl]amino]-1,1-dimethylethyl]sulfanyl]acetate hydrochloride
Molecular Weight601.28
Molecular FormulaC31H52N2O5S.ClH
Canonical SMILESCl.CC(C)[C@@H](N)C(=O)NCC(C)(C)SCC(=O)O[C@@H]1C[C@@](C)(C=C)[C@@H](O)[C@H](C)[C@@]23CC[C@@H](C)[C@]1(C)[C@@H]2C(=O)CC3
InChIInChI=1S/C31H52N2O5S.ClH/c1-10-29(8)15-22(38-23(35)16-39-28(6,7)17-33-27(37)24(32)18(2)3)30(9)19(4)11-13-31(20(5)26(29)36)14-12-21(34)25(30)31
Accurate Mass600.3364
FormatNeat
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CATSizeShippingStorage ConditionsDescription
APS133868469-1 25MG Room Temperature -18°C Subcategory: Pharmaceutical and veterinary compounds and metabolites Inquiry
APS133868469-2 10MG Room Temperature 2-8°C Fridge/Coldroom Subcategory: European Pharmacopoeia (Ph. Eur.); API Family: Matrix - API Family See respective official monograph(s); Product Type: API Inquiry
APS133868469-3 10MG Room Temperature -20°C Freezer Subcategory: Antibiotics Inquiry
APS133868469-4 1MG Room Temperature -20°C Freezer Subcategory: Antibiotics Inquiry
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