M-HYDROXYCOCAINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H21NO5
Molecular Weight	319.3523
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1OC(=O)C3=CC=CC(O)=C3)N2C

InChI

InChIKey=IQXBUEUAOWARGT-PMOUVXMZSA-N

InChI=1S/C17H21NO5/c1-18-11-6-7-13(18)15(17(21)22-2)14(9-11)23-16(20)10-4-3-5-12(19)8-10/h3-5,8,11,13-15,19H,6-7,9H2,1-2H3/t11-,13+,14-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C17H21NO5
Molecular Weight	319.3523
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:58:28 GMT 2025` Edited by `admin` on `Mon Mar 31 17:58:28 GMT 2025`
Record UNII	DLE3EI4JVT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3'-HYDROXYBENZOYLECGONINE METHYL ESTER

Preferred Name

English

M-HYDROXYCOCAINE

Common Name

English

8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-((3-HYDROXYBENZOYL)OXY)-8-METHYL-, METHYL ESTER, (1R,2R,3S,5S)-

Systematic Name

English

3'-HYDROXYCOCAINE

Common Name

English

Code System Code Type Description

FDA UNII

DLE3EI4JVT

Created by admin on Mon Mar 31 17:58:28 GMT 2025 , Edited by admin on Mon Mar 31 17:58:28 GMT 2025

PRIMARY

PUBCHEM

11823332

Created by admin on Mon Mar 31 17:58:28 GMT 2025 , Edited by admin on Mon Mar 31 17:58:28 GMT 2025

PRIMARY

EPA CompTox

DTXSID60991723

Created by admin on Mon Mar 31 17:58:28 GMT 2025 , Edited by admin on Mon Mar 31 17:58:28 GMT 2025

PRIMARY

CAS

71387-58-1

Created by admin on Mon Mar 31 17:58:28 GMT 2025 , Edited by admin on Mon Mar 31 17:58:28 GMT 2025

PRIMARY

Related Record Type Details


					I5Y540LHVR

COCAINE

PARENT -> METABOLITE

Qualification:

URINE

Amount: