5-CARBOXAMIDOTRYPTAMINE MALEATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H13N3O.C4H4O4
Molecular Weight	319.3126
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 5-CARBOXAMIDOTRYPTAMINE MALEATE

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.NCCC1=CNC2=CC=C(C=C12)C(N)=O

InChI

InChIKey=PZQZSWAOVAMBQM-BTJKTKAUSA-N

InChI=1S/C11H13N3O.C4H4O4/c12-4-3-8-6-14-10-2-1-7(11(13)15)5-9(8)10;5-3(6)1-2-4(7)8/h1-2,5-6,14H,3-4,12H2,(H2,13,15);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	C11H13N3O
Molecular Weight	203.2404
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:52:42 GMT 2023` Edited by `admin` on `Sat Dec 16 08:52:42 GMT 2023`
Record UNII	6PED53BA7M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-CARBOXAMIDOTRYPTAMINE MALEATE

Common Name

English

1H-INDOLE-5-CARBOXAMIDE, 3-(2-AMINOETHYL)-, (2Z)-2-BUTENEDIOATE (1:1)

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID201017355

Created by admin on Sat Dec 16 08:52:42 GMT 2023 , Edited by admin on Sat Dec 16 08:52:42 GMT 2023

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CAS

74885-72-6

Created by admin on Sat Dec 16 08:52:42 GMT 2023 , Edited by admin on Sat Dec 16 08:52:42 GMT 2023

PRIMARY

CAS

118202-69-0

Created by admin on Sat Dec 16 08:52:42 GMT 2023 , Edited by admin on Sat Dec 16 08:52:42 GMT 2023

NON-SPECIFIC STOICHIOMETRY

PUBCHEM

11709509

Created by admin on Sat Dec 16 08:52:42 GMT 2023 , Edited by admin on Sat Dec 16 08:52:42 GMT 2023

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FDA UNII

6PED53BA7M

Created by admin on Sat Dec 16 08:52:42 GMT 2023 , Edited by admin on Sat Dec 16 08:52:42 GMT 2023

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Related Record Type Details


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5-CARBOXAMIDOTRYPTAMINE

PARENT -> SALT/SOLVATE