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Levallorphan Tartrate Salt

CAT: 1596-AR-L06943-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-L06943-01Size:10 Units
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CAS Number
71-82-9
Molecular Formula
C19H25NO. C4H6O6
Molecular Weight
283.42 150.09
API Name
Levallorphan

Chemical Information

Levallorphan Tartrate

See also: Levallorphan (has active moiety) ... View More ...

CAS Number71-82-9
PubChem CID5464111
IUPAC Name(2R,3R)-2,3-dihydroxybutanedioic acid;(1R,9R,10R)-17-prop-2-enyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
Molecular FormulaC23H31NO7
Molecular Weight433.5
Topological Polar Surface Area139
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity542
SMILES
C=CCN1CC[C@]23CCCC[C@H]2[C@H]1CC4=C3C=C(C=C4)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChI
InChI=1S/C19H25NO.C4H6O6/c1-2-10-20-11-9-19-8-4-3-5-16(19)18(20)12-14-6-7-15(21)13-17(14)19;5-1(3(7)8)2(6)4(9)10/h2,6-7,13,16,18,21H,1,3-5,8-12H2;1-2,5-6H,(H,7,8)(H,9,10)/t16-,18+,19+;1-,2-/m01/s1
InChIKey
FWMLYVACGDQRFU-ZTMWJVNESA-N
Chemical Structure
2D Structure
2D structure of Levallorphan Tartrate
CAS: 71-82-9
CID: 5464111
Formula: C23H31NO7
MW: 433.5
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight433.5
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass433.21005233
Monoisotopic Mass433.21005233
Topological Polar Surface Area139 Ų
Heavy Atom Count31
Formal Charge0
Complexity542
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes