ECGONIDINE, (±)-

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H13NO2
Molecular Weight	167.205
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ECGONIDINE, (±)-

Structure Search

SMILES

[H][C@@]12CC[C@@]([H])(N1C)C(=CC2)C(O)=O

InChI

InChIKey=HZGRVVUQEIBCMS-HTRCEHHLSA-N

InChI=1S/C9H13NO2/c1-10-6-2-4-7(9(11)12)8(10)5-3-6/h4,6,8H,2-3,5H2,1H3,(H,11,12)/t6-,8-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C9H13NO2
Molecular Weight	167.205
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:42:46 UTC 2023` Edited by `admin` on `Sat Dec 16 10:42:46 UTC 2023`
Record UNII	3B20GC4OUU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ECGONIDINE, (±)-

Common Name

English

8-AZABICYCLO(3.2.1)OCT-2-ENE-2-CARBOXYLIC ACID, 8-METHYL-

Systematic Name

English

(±)-ECGONIDINE

Common Name

English

ECGONIDINE (±)-FORM [MI]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID00901169

Created by admin on Sat Dec 16 10:42:46 UTC 2023 , Edited by admin on Sat Dec 16 10:42:46 UTC 2023

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CAS

127379-23-1

Created by admin on Sat Dec 16 10:42:46 UTC 2023 , Edited by admin on Sat Dec 16 10:42:46 UTC 2023

NON-SPECIFIC STEREOCHEMISTRY

PUBCHEM

11564684

Created by admin on Sat Dec 16 10:42:46 UTC 2023 , Edited by admin on Sat Dec 16 10:42:46 UTC 2023

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FDA UNII

3B20GC4OUU

Created by admin on Sat Dec 16 10:42:46 UTC 2023 , Edited by admin on Sat Dec 16 10:42:46 UTC 2023

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MERCK INDEX

m4809

Created by admin on Sat Dec 16 10:42:46 UTC 2023 , Edited by admin on Sat Dec 16 10:42:46 UTC 2023

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Merck Index