ECGONINE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C9H15NO3
Molecular Weight	185.2203
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ECGONINE

Structure Search

SMILES

CN1[C@H]2CC[C@@H]1[C@H]([C@@H](O)C2)C(O)=O

InChI

InChIKey=PHMBVCPLDPDESM-FKSUSPILSA-N

InChI=1S/C9H15NO3/c1-10-5-2-3-6(10)8(9(12)13)7(11)4-5/h5-8,11H,2-4H2,1H3,(H,12,13)/t5-,6+,7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C9H15NO3
Molecular Weight	185.2203
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 `Fri Dec 15 15:05:49 UTC 2023` Edited by `admin` on `Fri Dec 15 15:05:49 UTC 2023`
Record UNII	DX2E9E17AV
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ECGONINE

Common Name

English

IDS-NE-001

Code

English

ECGONINE [MI]

Common Name

English

3.BETA.-HYDROXY-1.ALPHA.H,5.ALPHA.H-TROPANE-2.BETA.-CARBOXYLIC ACID

Common Name

English

3.BETA.-HYDROXY-2.BETA.-TROPANECARBOXYLIC ACID

Common Name

English

Ecgonine [WHO-DD]

Common Name

English

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

Systematic Name

English

EKGONIN

Common Name

English

Classification Tree Code System Code

DEA NO.

9180

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

Code System Code Type Description

ECHA (EC/EINECS)

207-565-4

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

PRIMARY

DRUG BANK

DB01525

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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WIKIPEDIA

ECGONINE

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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MESH

C005617

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

PRIMARY

EPA CompTox

DTXSID701019899

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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PUBCHEM

91460

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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CHEBI

4743

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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CAS

481-37-8

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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FDA UNII

DX2E9E17AV

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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MERCK INDEX

m4810

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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Merck Index

EVMPD

SUB33203

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

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SMS_ID

100000126157

Created by admin on Fri Dec 15 15:05:49 UTC 2023 , Edited by admin on Fri Dec 15 15:05:49 UTC 2023

PRIMARY

Related Record Type Details


					58C337KP3E

METHYL ECGONIDINE

PARENT -> SALT/SOLVATE


					VY81V42YYZ

ECGONINE METHYL ESTER HYDROCHLORIDE

PARENT -> SALT/SOLVATE


					6VT73464P7

BENZOYLPROPYLESTER ECGONINE

PARENT -> SALT/SOLVATE

Amount:


					WFK26TP15R

ECGONINE METHYL ESTER 2,6-DIMETHYLBENZOATE

SALT/SOLVATE -> PARENT

Comments:

APPROXIMATE PURE ANHYDROUS DRUG CONTENT (IN PERCENT)

Amount:


					ET3PMG0528

ECGONINE MONOHYDRATE

SALT/SOLVATE -> PARENT

Amount:


					ET3PMG0528

ECGONINE MONOHYDRATE

SOLVATE->ANHYDROUS

Related Record Type Details


					DX2E9E17AV

ECGONINE

ACTIVE MOIETY