6-(2-AMINOPROPYL)INDOLE MALEATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C11H14N2.C4H4O4
Molecular Weight	290.3144
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 6-(2-AMINOPROPYL)INDOLE MALEATE

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.CC(N)CC1=CC2=C(C=CN2)C=C1

InChI

InChIKey=XKFGCLQBEJVGQK-BTJKTKAUSA-N

InChI=1S/C11H14N2.C4H4O4/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9;5-3(6)1-2-4(7)8/h2-5,7-8,13H,6,12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C11H14N2
Molecular Weight	174.2423
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
monoamine oxidase activity 6 Target ID: GO:0097621 Sources: https://www.ncbi.nlm.nih.gov/pubmed/5658327	Inhibitor 8297		4.6 µM [IC50]

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:04:20 UTC 2023` Edited by `admin` on `Fri Dec 15 15:04:20 UTC 2023`
Record UNII	M7C77J017A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

6-(2-AMINOPROPYL)INDOLE MALEATE

Systematic Name

English

1H-INDOLE-6-ETHANAMINE, .ALPHA.-METHYL-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

INDOLE, 6-(2-AMINOPROPYL)-, MALEATE (1:1)

Systematic Name

English

1H-INDOLE-6-ETHANAMINE, .ALPHA.-METHYL-, (Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID101030108

Created by admin on Fri Dec 15 15:04:20 UTC 2023 , Edited by admin on Fri Dec 15 15:04:20 UTC 2023

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CAS

22196-72-1

Created by admin on Fri Dec 15 15:04:20 UTC 2023 , Edited by admin on Fri Dec 15 15:04:20 UTC 2023

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PUBCHEM

23619741

Created by admin on Fri Dec 15 15:04:20 UTC 2023 , Edited by admin on Fri Dec 15 15:04:20 UTC 2023

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FDA UNII

M7C77J017A

Created by admin on Fri Dec 15 15:04:20 UTC 2023 , Edited by admin on Fri Dec 15 15:04:20 UTC 2023

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