ALLANTOIN GALACTURONIC ACID

Details

Stereochemistry	EPIMERIC
Molecular Formula	C6H10O7.C4H6N4O3
Molecular Weight	352.2548
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 5
E/Z Centers	0
Charge	0
Stereo Comments	C4H6N4O3

SHOW SMILES / InChI

Structure of ALLANTOIN GALACTURONIC ACID

Structure Search

SMILES

NC(=O)NC1NC(=O)NC1=O.O[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)C(O)=O

InChI

InChIKey=HXVHQYMITPIBOD-RMTXHFLUSA-N

InChI=1S/C6H10O7.C4H6N4O3/c7-1-2(8)3(9)4(10)5(11)6(12)13;5-3(10)6-1-2(9)8-4(11)7-1/h1-5,8-11H,(H,12,13);1H,(H3,5,6,10)(H2,7,8,9,11)/t2-,3+,4+,5-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C6H10O7
Molecular Weight	194.1394
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	4 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

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 00:49:31 UTC 2023` Edited by `admin` on `Sat Dec 16 00:49:31 UTC 2023`
Record UNII	M25U72FT59
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALLANTOIN GALACTURONIC ACID

Official Name

English

ALLANTOIN GALACTURONIC ACID [INCI]

Common Name

English

ALLANTOIN, MONOGALACTOPYRANURONATE

Common Name

English

GALACTOPYRANURONIC ACID, COMPD. WITH ALLANTOIN (1:1)

Common Name

English

Code System Code Type Description

FDA UNII

M25U72FT59

Created by admin on Sat Dec 16 00:49:31 UTC 2023 , Edited by admin on Sat Dec 16 00:49:31 UTC 2023

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PUBCHEM

87319941

Created by admin on Sat Dec 16 00:49:31 UTC 2023 , Edited by admin on Sat Dec 16 00:49:31 UTC 2023

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EPA CompTox

DTXSID00199206

Created by admin on Sat Dec 16 00:49:31 UTC 2023 , Edited by admin on Sat Dec 16 00:49:31 UTC 2023

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CAS

5119-24-4

Created by admin on Sat Dec 16 00:49:31 UTC 2023 , Edited by admin on Sat Dec 16 00:49:31 UTC 2023

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