ALLANTOIN PABA

Details

Stereochemistry	RACEMIC
Molecular Formula	C7H7NO2.C4H6N4O3
Molecular Weight	295.2514
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=CC=C(C=C1)C(O)=O.NC(=O)NC2NC(=O)NC2=O

InChI

InChIKey=QWVSDCVMXDUGML-UHFFFAOYSA-N

InChI=1S/C7H7NO2.C4H6N4O3/c8-6-3-1-5(2-4-6)7(9)10;5-3(10)6-1-2(9)8-4(11)7-1/h1-4H,8H2,(H,9,10);1H,(H3,5,6,10)(H2,7,8,9,11)

HIDE SMILES / InChI

Molecular Formula	C7H7NO2
Molecular Weight	137.136
Charge	0
Count

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

Molecular Formula	C4H6N4O3
Molecular Weight	158.1154
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:01:54 UTC 2023` Edited by `admin` on `Sat Dec 16 20:01:54 UTC 2023`
Record UNII	7NAA1SZ9N2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALLANTOIN PABA

Official Name

English

ALPABA

Common Name

English

ALLANTOIN, MONO-P-AMINOBENZOATE

Common Name

English

UREA, (2,5-DIOXO-4-IMIDAZOLIDINYL)-, MONO(4-AMINOBENZOATE)

Common Name

English

ALLANTOIN PABA [INCI]

Common Name

English

BENZOIC ACID, P-AMINO-, COMPD. WITH ALLANTOIN (1:1)

Common Name

English

ALLANTOIN, P-AMINOBENZOATE

Common Name

English

BENZOIC ACID, 4-AMINO-, COMPD. WITH (2,5-DIOXO-4-IMIDAZOLIDINYL)UREA

Common Name

English

Code System Code Type Description

FDA UNII

7NAA1SZ9N2

Created by admin on Sat Dec 16 20:01:54 UTC 2023 , Edited by admin on Sat Dec 16 20:01:54 UTC 2023

PRIMARY

PUBCHEM

3083839

Created by admin on Sat Dec 16 20:01:54 UTC 2023 , Edited by admin on Sat Dec 16 20:01:54 UTC 2023

PRIMARY

CAS

4207-42-5

Created by admin on Sat Dec 16 20:01:54 UTC 2023 , Edited by admin on Sat Dec 16 20:01:54 UTC 2023

PRIMARY

EPA CompTox

DTXSID40884048

Created by admin on Sat Dec 16 20:01:54 UTC 2023 , Edited by admin on Sat Dec 16 20:01:54 UTC 2023

PRIMARY

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