COCAINE SULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H21NO4.H2O4S
Molecular Weight	401.431
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=OHOXZHVORBDIEV-VZXSFKIWSA-N

InChI=1S/C17H21NO4.H2O4S/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;1-5(2,3)4/h3-7,12-15H,8-10H2,1-2H3;(H2,1,2,3,4)/t12-,13+,14-,15+;/m0./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

COCAINE SULFATE

Common Name

English

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

Systematic Name

English

1.ALPHA.H,5.ALPHA.H-TROPANE-2.BETA.-CARBOXYLIC ACID, 3.BETA.-HYDROXY-, METHYL ESTER, BENZOATE (ESTER), SULFATE (1:1)

Common Name

English

Code System Code Type Description

FDA UNII

GG6P4Q1KNT

Created by admin on Sat Dec 16 08:29:47 UTC 2023 , Edited by admin on Sat Dec 16 08:29:47 UTC 2023

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PUBCHEM

56841038

Created by admin on Sat Dec 16 08:29:47 UTC 2023 , Edited by admin on Sat Dec 16 08:29:47 UTC 2023

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EPA CompTox

DTXSID70974567

Created by admin on Sat Dec 16 08:29:47 UTC 2023 , Edited by admin on Sat Dec 16 08:29:47 UTC 2023

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CAS

5913-65-5

Created by admin on Sat Dec 16 08:29:47 UTC 2023 , Edited by admin on Sat Dec 16 08:29:47 UTC 2023

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ACTIVE MOIETY


					I5Y540LHVR

COCAINE

SUBSTANCE RECORD


					GG6P4Q1KNT

COCAINE SULFATE