KAINIC ACID MONOHYDRATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C10H15NO4.H2O
Molecular Weight	231.2457
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.CC(=C)[C@H]1CN[C@@H]([C@H]1CC(O)=O)C(O)=O

InChI

InChIKey=FZNZRJRSYLQHLT-SLGZUKMRSA-N

InChI=1S/C10H15NO4.H2O/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13;/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15);1H2/t6-,7+,9-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C10H15NO4
Molecular Weight	213.2304
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 06:02:25 UTC 2023` Edited by `admin` on `Sat Dec 16 06:02:25 UTC 2023`
Record UNII	I519JC63XY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

KAINIC ACID MONOHYDRATE

Common Name

English

3-PYRROLIDINEACETIC ACID, 2-CARBOXY-4-(1-METHYLETHENYL)-, MONOHYDRATE, (2S-(2.ALPHA.,3.BETA.,4.BETA.))-

Common Name

English

KAINIC ACID HYDRATE [JAN]

Common Name

English

3-PYRROLIDINEACETIC ACID, 2-CARBOXY-4-(1-METHYLETHENYL)-, HYDRATE (1:1), (2S,3S,4S)-

Common Name

English

(-)-KAINIC ACID HYDRATE

Common Name

English

KAINIC ACID HYDRATE

Common Name

English

Code System Code Type Description

FDA UNII

I519JC63XY

Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023

PRIMARY

EPA CompTox

DTXSID50206732

Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023

PRIMARY

CAS

58002-62-3

Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023

PRIMARY

PUBCHEM

11954253

Created by admin on Sat Dec 16 06:02:25 UTC 2023 , Edited by admin on Sat Dec 16 06:02:25 UTC 2023

PRIMARY

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