Paracodeine bitartrate structure

Paracodeine bitartrate

2,3-dihydroxybutanedioic acid;9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol

Also Known As: Tuscodin|DIHYDROCODEINE|Dihydrocodeine bitartrate|Paracodeine bitartrate|Hydrocodeine bitartrate|Dihydrocodeine acid tartrate|Codeine, tartrate (1:1)|Hydrocodeine hydrogen tartrate|dihydrocodeine hydrogen tartrate|DIHYDRO-CODEINE, TARTRATE|DF 118|Morphinan-6.alpha.-ol,5.alpha.-epoxy-3-methoxy-17-methyl-, tartrate (1:1)|Morphinan-6.alpha.-ol,5.alpha.-epoxy-3-methoxy-17-methyl-, tartrate (1:1) (salt)|(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol;(2R,3R)-2,3-dihydroxybutanedioic acid|Morphinan-6-ol,5-epoxy-3-methoxy-17-methyl-, (5.alpha.,6.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1) (salt)

CAS: 5965-13-9
Molecular Formula C22H29NO9
Molecular Weight 451.18423 g/mol
LogP -0.3975
Topological Polar Surface Area 157.0 Ų
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 10
Rotatable Bonds 4
Exact Mass 451.18423
Monoisotopic Mass 451.18423
Heavy Atoms 32
Complexity 605.0

Chemical Identifiers

CAS Number 5965-13-9
SMILES CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(CC4)O.C(C(C(=O)O)O)(C(=O)O)O
InChIKey ZGSZBVAEVPSPFM-UHFFFAOYSA-N

Product Overview

Paracodeine bitartrate (CAS 5965-13-9), with molecular formula C22H29NO9 and molecular weight 451.18423 g/mol. IUPAC: 2,3-dihydroxybutanedioic acid;9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol.

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