COCAINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H21NO4
Molecular Weight	303.3529
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=C3)N2C

InChI

InChIKey=ZPUCINDJVBIVPJ-LJISPDSOSA-N

InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

COCAINE

Common Name

English

Cocaine [WHO-DD]

Common Name

English

COCAINE [VANDF]

Common Name

English

RX-0041

Code

English

RX0041

Code

English

(R)-(-)-COCAINE

Common Name

English

COCAINE [MI]

Common Name

English

COCAINUM [HPUS]

Common Name

English

8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-(BENZOYLOXY)-8-METHYL-, METHYL ESTER, (1R-(EXO,EXO))-

Common Name

English

METHYL (1R,2R,3S,5S)-3-(BENZOYLOXY)-8-METHYL-8-AZABICYCLO(3.2.1) OCTANE-2-CARBOXYLATE

Systematic Name

English

NEUROCAINE

Common Name

English

METHYL 3B-HYDROXY-1.ALPHA.H,5.ALPHA.H-TROPANE-2.BETA.-CARBOXYLATE BENZOATE (ESTER)

Common Name

English

3.BETA.-HYDROXY-2.BETA.-TROPANECARBOXYLIC ACID METHYL ESTER BENZOATE (ESTER)

Common Name

English

COCAINUM

Common Name

English

COCAINE [MART.]

Common Name

English

ECGONINE METHYL ESTER BENZOATE (ESTER)

Common Name

English

BENZOYLMETHYLECGONINE

Common Name

English

COCAINE [HSDB]

Common Name

English

IDS-NC-004

Code

English

COCAINE [USP MONOGRAPH]

Common Name

English

Classification Tree Code System Code

WHO-ATC

R02AD03

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

WHO-ATC

S02DA02

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

WHO-VATC

QS02DA02

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

WHO-VATC

QN01BC01

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

YELLOW LIST

NC 004

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

NCI_THESAURUS

C47795

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

WHO-ATC

S01HA01

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

WHO-VATC

QR02AD03

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

WHO-VATC

QS01HA01

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

DEA NO.

9041

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

WHO-ATC

N01BC01

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

CFR

21 CFR 862.3250

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

Code System Code Type Description

LACTMED

Cocaine

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

MESH

D003042

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

CHEBI

60056

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

IUPHAR

2286

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

FDA UNII

I5Y540LHVR

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

CHEBI

27958

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

EVMPD

SUB13416MIG

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

NCI_THESAURUS

C80153

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

MERCK INDEX

m3710

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

Merck Index

ECHA (EC/EINECS)

200-032-7

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

DRUG CENTRAL

723

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

ChEMBL

CHEMBL370805

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

WIKIPEDIA

COCAINE

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

DAILYMED

I5Y540LHVR

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

HSDB

6469

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

DRUG BANK

DB00907

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

CAS

50-36-2

Created by admin on Fri Dec 15 15:15:05 UTC 2023 , Edited by admin on Fri Dec 15 15:15:05 UTC 2023

PRIMARY

EPA CompTox

DTXSID2038443

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

PUBCHEM

446220

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

SMS_ID

100000079767

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

RXCUI

2653

Created by admin on Fri Dec 15 15:15:06 UTC 2023 , Edited by admin on Fri Dec 15 15:15:06 UTC 2023

PRIMARY

RxNorm

ACTIVE MOIETY


					I5Y540LHVR

COCAINE

METABOLITE (PARENT)


					Y35FJB3QBJ

ECGONINE METHYL ESTER

METABOLITE (PARENT)


					FJO3071W5Y

COCAETHYLENE

METABOLITE (PARENT)


					NK68KDX4WF

Anhydroecgonine ethyl ester

METABOLITE (PARENT)


					DLE3EI4JVT

M-HYDROXYCOCAINE

METABOLITE (PARENT)


					6VT73464P7

BENZOYLPROPYLESTER ECGONINE

METABOLITE (PARENT)


					V317H7U0XL

P-HYDROXYCOCAINE

METABOLITE ACTIVE (PARENT)


					K8J4W658QK

2'-HYDROXYCOCAINE

PARENT (METABOLITE)


					5353I8I6YS

BENZOYLECGONINE

PARENT (SALT/SOLVATE)


					QL5NZ3JM5F

COCAINE HYDROBROMIDE

PARENT (SALT/SOLVATE)


					GG6P4Q1KNT

COCAINE SULFATE

PARENT (SALT/SOLVATE)


					9BFT5BK9YZ

COCAINE NITRATE DIHYDRATE

SALT/SOLVATE (PARENT)


					XH8T8T6WZH

COCAINE HYDROCHLORIDE

SALT/SOLVATE (PARENT)


					2RT6KC9AZ6

COCAINE BORATE

SALT/SOLVATE (PARENT)


					WMG69LB74K

COCAINE HYDRIODIDE

SALT/SOLVATE (PARENT)


					WM3M8W3FYR

COCAINE CITRATE