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VALNEMULIN HYDROCHLORIDE · CAS 133868-46-9 · C31H53ClN2O5S. UNII W1GDP58BNQ.
| CAS Registry Number | 133868-46-9 |
|---|---|
| PubChem CID | 60195218 |
| Molecular formula | C31H53ClN2O5S |
| IUPAC name | [(1S,2R,3S,4S,6R,7R,8R,14R)-4-ethenyl-3-hydroxy-2,4,7,14-tetramethyl-9-oxo-6-tricyclo[5.4.3.01,8]tetradecanyl] 2-[1-[[(2R)-2-amino-3-methylbutanoyl]amino]-2-methylpropan-2-yl]sulfanylacetate;hydrochloride |
| UNII (FDA) | W1GDP58BNQ |
| Molecular Weight | 601.3 |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 10 |
| Exact Mass | 600.3363717 |
| Monoisotopic Mass | 600.3363717 |
| Topological Polar Surface Area | 144 |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 969 |
| Reported hazard statements | H302 (100%), H319 (66.7%), H335 (66.7%), H373 (16.7%), H400 (66.7%), H410 (66.7%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Valnemulin hydrochloride; 133868-46-9; UNII-W1GDP58BNQ; W1GDP58BNQ; DTXSID30158407; RefChem:56296; DTXCID8080898; Valnemulin HCl; Econor; Valnemulin hydrochloride [MI]; MFCD08458958; C31H53ClN2O5S; Valnemulin Hydrocloride; Valnemulin hydrochloride CRS; orb1222743; SCHEMBL1457012
CAS 133868-46-9; molecular formula C31H53ClN2O5S; molecular weight — g/mol.
Valnemulin hydrochloride, 133868-46-9, UNII-W1GDP58BNQ, W1GDP58BNQ, DTXSID30158407, RefChem:56296.
Hazard statements reported: H302, H319, H335, H373, H400.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.