Oxycodone
PubChem CID: 5284603
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| Compound Synonyms | oxycodone, Dihydrone, Dihydrohydroxycodeinone, Oxycodeinone, Dihydroxycodeinone, Oxicon, Diphydrone, Eucodalum, Oxycodon, Percobarb, 76-42-6, Oxicodona, Endone, Oxanest, Oxycontin, Dihydro-14-hydroxycodeinone, (-)-14-Hydroxydihydrocodeinone, Oxycodonum, Oxyfast, Supendol, Xtampza, OxyIR, Ossicodone, Endine (Australia), Remoxy, Oxycodonum [INN-Latin], Oxicodona [INN-Spanish], 14-Hydroxydihydrocodeinone, Eubine [France], Supendol [Canada], Codeinone, dihydrohydroxy-, Avridi, Oxyneo, PTI-821, Oxycodone cii, Pancodone Retard, Xtampza ER, Apo-oxycodone CR, Codeinone, dihydro-14-hydroxy-, 4,5alpha-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, Pancodone retard (United Kingdom), Pavinal, HSDB 3142, 4,5-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, oxymorphone 3-methyl ether, EINECS 200-960-2, Pti 821, UNII-CD35PMG570, NSC 19043, NSC-19043, PF-00345439, Oxicone, Codeinone, 7,8-dihydro-14-hydroxy-, BRN 0043446, CD35PMG570, CHEBI:7852, IDS-NO-002, N02AA05, Oxycodeinon, DTXSID5023407, Oxycone, Eubine (France), NSC19043, Supendol (Canada), Tekodin (free base), Ossicodone [DCIT], Oxycodonum (INN-Latin), Oxicodona (INN-Spanish), OXYCODONE (MART.), OXYCODONE [MART.], OXYCODONE CII (USP-RS), OXYCODONE CII [USP-RS], Oxycodone [USAN:INN:BAN], Dihydrohydroxycondeinone, 14-hydroxy-3-methoxy-17-methyl-5beta-4,5-epoxymorphinan-6-one, (4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one, (-)-Oxycodone, CHEMBL656, Oxycodone (USAN/INN), oxicodone, 4,5.alpha.-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, Oxycodone SR, HYDROCODONE HYDROGEN TARTRATE 2.5-HYDRATE IMPURITY D (EP IMPURITY), HYDROCODONE HYDROGEN TARTRATE 2.5-HYDRATE IMPURITY D [EP IMPURITY], Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5.alpha.)-, Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5alpha)-, OOX, Oxycodonum (Latin), XTAMPZAER, OXYCODONE [INN], OXYCODONE [MI], OXYCODONE [HSDB], OXYCODONE [USAN], Morphinan-6-one, 4,5alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-, OXYCODONE [VANDF], OXYCODONE [WHO-DD], SCHEMBL2737, 14-cis-Hydroxydihydrocodeinone, DTXCID903407, GTPL7093, PF06, OXYCODONE [ORANGE BOOK], Codeinone,8-dihydro-14-hydroxy-, Oxycodone 0.1 mg/ml in Methanol, Oxycodone 1.0 mg/ml in Methanol, 14-hydroxy-3-methoxy-17-methyl-4,5alpha-epoxymorphinan-6-one, (5-alpha)-4,5-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, BDBM50370595, Morphinan-6-one, 4,5-alpha-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5alpha)-14-hydroxy-17-methyl-3-(methyloxy)-4,5-epoxymorphinan-6-one, DB00497, AC-16043, DB-243425, C08018, D05312, Q407535, Morphinan-6-one,5.alpha.-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5alpha)-4,5-EPOXY-14-HYDROXY-3-METHOXY-17-METHYLMORPHINAN-6-ONE, Morphinan-6-one,5-epoxy-14-hydroxy-3-methoxy-17-methyl-, (5.alpha.)-, WLN: T B6566 B6/CO 4ABBC R BX FV HO PN GHT&&TTJ CQ JO1 P1, (5.ALPHA.)-4,5-EPOXY-14-HYDROXY-3-METHOXY-17-METHYLMORPHINAN-6-ONE, 4aH-8,5-bcd]furan-5(6H)-one, 7,7a,8,9-tetrahydro-7a-hydroxy-3-methoxy-12-methyl-, (1S,5R,13R,17S)-17-hydroxy-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one, (4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one, 200-960-2 |
|---|---|
| Topological Polar Surface Area | 59.0 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 553.0 |
| Database Name | cmaup_ingredients;hmdb_chem_all;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 4.0 |
| Uniprot Id | P08684, P10635, P20815, P24462, P41143, P35372, P41145, P33535, P33533, P34975, P41144, O42275, n.a., P22310, P54855, P42866, P33534, O15245, Q99720, P20272, Q12809 |
| Iupac Name | (4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-3-methyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one |
| Prediction Hob | 1.0 |
| Class | Phenanthrenes and derivatives |
| Target Id | NPT272, NPT271, NPT145, NPT613 |
| Xlogp | 1.2 |
| Superclass | Benzenoids |
| Molecular Formula | C18H21NO4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BRUQQQPBMZOVGD-XFKAJCMBSA-N |
| Fcsp3 | 0.6111111111111112 |
| Logs | -2.105 |
| Rotatable Bond Count | 1.0 |
| State | Solid |
| Logd | 0.573 |
| Synonyms | (-)-14-Hydroxydihydrocodeinone, 4,5-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, 4,5alpha-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, Dihydro-14-hydroxycodeinone, Dihydrohydroxycodeinone, Dihydroxycodeinone, Oxicodona, Oxycodonum, 4,5a-Epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, 4,5Α-epoxy-14-hydroxy-3-methoxy-17-methylmorphinan-6-one, Dihydrohydroxycondeinone, Dihydrone, PTI-821, Dinarkon, Oxiconum, Oxycone, Oxycontin, Theocodin, Eucodal, Oxycodeinon, Oxycodone hydrochloride, Pancodine, Purdue frederick brand OF oxycodone |
| Compound Name | Oxycodone |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 315.147 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 315.147 |
| Hydrogen Bond Acceptor Count | 5.0 |
| Molecular Weight | 315.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 4.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Esol | -1.3238312782608697 |
| Inchi | InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3/t13-,16+,17+,18-/m1/s1 |
| Smiles | CN1CC[C@]23[C@@H]4C(=O)CC[C@]2([C@H]1CC5=C3C(=C(C=C5)OC)O4)O |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Phenanthrenes and derivatives |
- 1. Outgoing r'ship
FOUND_INto/from Papaver Somniferum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all