CODEINONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H19NO3
Molecular Weight	297.3484
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC3=C(OC)C=CC4=C3[C@@]15CCN(C)[C@]([H])(C4)[C@]5([H])C=CC2=O

InChI

InChIKey=XYYVYLMBEZUESM-CMKMFDCUSA-N

InChI=1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H19NO3
Molecular Weight	297.3484
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Targets

Primary Target	Pharmacology	Potency
apoptotic process 48 Target ID: GO:0006915 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12894543	Activator 1430
NADPH-dependent codeinone reductase 1-1 2 Target ID: Q9SQ70 Gene ID: NA Gene Symbol: COR1.1 Target Organism: Papaver somniferum (Opium poppy) Sources: https://www.ncbi.nlm.nih.gov/pubmed/10417697 \| https://www.ncbi.nlm.nih.gov/pubmed/29779229	Substrate 661
Mu-type opioid receptor 61 Target ID: P35372\|\|\|G8XRH8\|\|\|Q5TDA1\|\|\|Q9UN57 Gene ID: 4988.0 Gene Symbol: OPRM1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/17616524	Agonist 2678	294.0 nM [EC50]

PubMed

Title	Date	PubMed
Effects of glutathione and phenobarbital on the toxicity of codeinone.	1986 May 15	3707597
14-Hydroxylation of opiates: catalytic direct autoxidation of codeinone to 14-hydroxycodeinone.	2005 May 25	15898757
Structural determinants of opioid activity in derivatives of 14-aminomorphinones: effects of changes to the chain linking of the C14-amino group to the aryl ring.	2006 Oct 5	17004724
Linear-dichroic infrared spectral (IR-LD) analysis of codeine and its derivatives.	2007 May	17254838

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:19:47 GMT 2023` Edited by `admin` on `Sat Dec 16 08:19:47 GMT 2023`
Record UNII	22B5AW0ANN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CODEINONE

Common Name

English

6-OXOCODEINE

Common Name

English

6-CODEINONE

Common Name

English

(-)-CODEINONE

Common Name

English

CODEINE MONOHYDRATE IMPURITY I [EP IMPURITY]

Common Name

English

OXYCODONE RELATED COMPOUND C CII

Common Name

English

MORPHINAN-6-ONE, 7,8-DIDEHYDRO-4,5-EPOXY-3-METHOXY-17-METHYL-, (5.ALPHA.)-

Systematic Name

English

OXYCODONE RELATED COMPOUND C [USP-RS]

Common Name

English

CODEINE HYDROCHLORIDE DIHYDRATE IMPURITY I [EP IMPURITY]

Common Name

English

MORPHINAN-6-ONE, 7,8-DIDEHYDRO-4,5.ALPHA.-EPOXY-3-METHOXY-17-METHYL-

Systematic Name

English

OXYCODONE RELATED COMPOUND C

Common Name

English

CODEINE PHOSPHATE HEMIHYDRATE IMPURITY I [EP IMPURITY]

Common Name

English

HYDROCODONE HYDROGEN TARTRATE 2.5-HYDRATE IMPURITY E [EP IMPURITY]

Common Name

English

OXYCODONE RELATED COMPOUND C [USP IMPURITY]

Common Name

English

Code System Code Type Description

RS_ITEM_NUM

1485238