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Morphine Sulfate; Naltrexone Hydrochloride

HCID 90479727
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Basic informationOverviewNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
1131418-84-2
Standard SMILES
C[NH+]1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5.C[NH+]1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5.Cl.O=C1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5.O=S(=O)([O-])[O-]
InChIKey
GHQDFWSQYLBXJZ-OIEAAWCKSA-N
Molecular formula
C54H64ClN3O14S
Average molar mass
1,046.6 g/mol
Monoisotopic mass
1,045.3797526

Overview

See also: Morphine Sulfate (has component); Naltrexone Hydrochloride (has component).

Names & identifiers

Preferred name
Morphine Sulfate; Naltrexone Hydrochloride
IUPAC
(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one;bis((4R,4aR,7S,7aR,12bS)-3-methyl-1,2,3,4,4a,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-3-ium-7,9-diol);sulfate;hydrochloride

Names & synonyms

EmbedaNaltrexone hydrochloride / morphine sulfateMORPHINE SUFATERefChem:58014Naltrexone hydrochloride/morphine sulfateMorphine Sulfate; Naltrexone HydrochlorideNALTREXONE HYDROCHLORIDE;MORPHINE SULFATEKadian NTALO-01Morphine sulfate and naltrexone hydrochlorideNaltrexone hydrochloride and morphine sulfateMorphine Sulfate Plus Naltrexone Hydrochloride
Show more names
Morphine sulfate - naltrexone hydrochloride mixt.1131418-84-2

Database identifiers

CAS
1131418-84-2
PubChem CID
90479727

Properties

Computed structural properties

Topological polar surface area
267 Ų
Hydrogen bond donors
9
Hydrogen bond acceptors
15
Rotatable bonds
2
Heavy atoms
73
Formal charge
0
Complexity
1,180

Experimental & physicochemical properties

Human DrugsFDA approved drugs -> Active ingredient

Related reactions

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Compound notes

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