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10-Oxo Oxymorphone

CAT: 0572-TRC-O858400-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-O858400-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
96445-15-7
Synonyms
(5α)-4,5-Epoxy-3,14-dihydroxy-17-methylmorphinan-6,10-dione; 10-Keto-oxymorphone; 10-Oxooxymorphone
Hazard Statement
Harmful if swallowed.
Smiles
CN1CC[C@]23[C@H]4Oc5c(O)ccc(C(=O)[C@@H]1[C@]2(O)CCC4=O)c35
Molecular Formula
C17 H17 N O5
Molecular Weight
315.32
InChI
InChI=1S/C17H17NO5/c1-18-7-6-16-11-8-2-3-9(19)13(11)23-15(16)10(20)4-5-17(16,22)14(18)12(8)21/h2-3,14-15,19,22H,4-7H2,1H3/t14-,15+,16+,17-/m1/s1
Additionnal Information
IUPAC name: (4S,4aS,7aR,12bS)-4a,9-dihydroxy-3-methyl-1,2,4,5,6,7a-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7,13-dione
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

10-Ketooxymorphone

lower affinity for opioid binding sites than oxymorphone; RN & structure given in first source; RN not in Chemline 8/85

CAS Number96445-15-7
PubChem CID5486981
IUPAC Name(4S,4aS,7aR,12bS)-4a,9-dihydroxy-3-methyl-1,2,4,5,6,7a-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7,13-dione
Molecular FormulaC17H17NO5
Molecular Weight315.32
XLogP0.3
Topological Polar Surface Area87.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count23
Formal Charge0
Complexity608
SMILES
CN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1C(=O)C5=C3C(=C(C=C5)O)O4)O
InChI
InChI=1S/C17H17NO5/c1-18-7-6-16-11-8-2-3-9(19)13(11)23-15(16)10(20)4-5-17(16,22)14(18)12(8)21/h2-3,14-15,19,22H,4-7H2,1H3/t14-,15+,16+,17-/m1/s1
InChIKey
NKNGMQYKBKVDKI-LTIDMASMSA-N
Chemical Structure
2D Structure
2D structure of 10-Ketooxymorphone
CAS: 96445-15-7
CID: 5486981
Formula: C17H17NO5
MW: 315.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.32
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass315.11067264
Monoisotopic Mass315.11067264
Topological Polar Surface Area87.1 Ų
Heavy Atom Count23
Formal Charge0
Complexity608
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
286122-0110-Oxo oxymorphone discontinued
411720-0110α-Hydroxy Oxymorphone discontinued
CS-T-57096Oxymorphone
CS-O-35364Oxymorphone butylbromide
VFA22503-01Oxymorphone-d3
AR-M03671-01Oxymorphone Acetate
461766-01Oxymorphone Hydrochloride discontinued
FH24080-016-Hydroxy oxymorphone
IRB33003-01Oxymorphone hydrochloride monohydrate
460865-01Nor Oxymorphone discontinued

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