COCAINE METHIODIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H24NO4.I
Molecular Weight	445.2919
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[I-].COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)C3=CC=CC=C3)[N+]2(C)C

InChI

InChIKey=NUJUJJCMBQWIFW-JRJWNBDDSA-M

InChI=1S/C18H24NO4.HI/c1-19(2)13-9-10-14(19)16(18(21)22-3)15(11-13)23-17(20)12-7-5-4-6-8-12;/h4-8,13-16H,9-11H2,1-3H3;1H/q+1;/p-1/t13-,14+,15-,16+;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C18H24NO4
Molecular Weight	318.3875
Charge	1
Count

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

Molecular Formula	HI
Molecular Weight	127.9124
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Pathophysiological and pharmacological mechanisms of acute cocaine toxicity in conscious rats.	1992 Sep	1527734
The role of peripheral and central sodium channels in mediating brain temperature fluctuations induced by intravenous cocaine.	2006 Oct 30	16956595
Rapid EEG desynchronization and EMG activation induced by intravenous cocaine in freely moving rats: a peripheral, nondopamine neural triggering.	2010 Feb	19939972

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:33:00 GMT 2023` Edited by `admin` on `Sat Dec 16 08:33:00 GMT 2023`
Record UNII	83FKO5XD6J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

COCAINE METHIODIDE

Common Name

English

(-)-COCAINE METHIODIDE

Common Name

English

8-AZONIABICYCLO(3.2.1)OCTANE, 3-(BENZOYLOXY)-2-(METHOXYCARBONYL)-8,8-DIMETHYL-, IODIDE (1:1), (1R,2R,3S,5S)-

Systematic Name

English

1.ALPHA.H,5.ALPHA.H-TROPANIUM, 2.BETA.-CARBOXY-3.BETA.-HYDROXY-8-METHYL-, IODIDE, METHYL ESTER, BENZOATE

Common Name

English

Code System Code Type Description

PUBCHEM

83828