VALNEMULIN HYDROCHLORIDE (CAS 133868-46-9) — formula C31H53ClN2O5S, molecular weight 601.3; category organic chemicals.
| CAS Number | 133868-46-9 |
|---|---|
| Molecular Formula | C31H53ClN2O5S |
| Molecular Weight | 601.3 |
| Category | Organic Chemicals |
VALNEMULIN HYDROCHLORIDE is a carbon-based organic compound with CAS registry number 133868-46-9 and molecular formula C31H53ClN2O5S (molecular weight 601.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 133868-46-9
Its molecular formula C31H53ClN2O5S comprises 31 C, 53 H, 1 Cl, 2 N, 5 O, 1 S atoms.
Also known as: VALNEMULIN HYDROCHLORIDE · 盐酸伐尼莫林
Category: organic chemicals
The CAS registry number of VALNEMULIN HYDROCHLORIDE is 133868-46-9.
Molecular formula C31H53ClN2O5S, molecular weight 601.3.
It is also registered under: VALNEMULIN HYDROCHLORIDE, 盐酸伐尼莫林.
Category: Organic Chemicals.
Independent reference data for VALNEMULIN HYDROCHLORIDE (CAS 133868-46-9), compiled from public chemistry databases.
| 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 |
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
| 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 · CAS 133868-46-9 · C31H53ClN2O5S. UNII W1GDP58BNQ.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 盐酸伐尼莫林