Isofolic acid

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H19N7O6
Molecular Weight	441.3975
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=NC(=O)C2=NC(NCC3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)=CNC2=N1

InChI

InChIKey=IAUVIFJNDZCYPY-NSHDSACASA-N

InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)24-12(8-22-15)21-7-9-1-3-10(4-2-9)16(29)23-11(18(31)32)5-6-13(27)28/h1-4,8,11H,5-7H2,(H,21,24)(H,23,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C19H19N7O6
Molecular Weight	441.3975
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:47:29 GMT 2023` Edited by `admin` on `Sat Dec 16 19:47:29 GMT 2023`
Record UNII	EEA6VX2MJ7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Isofolic acid

Common Name

English

L-Glutamic acid, N-[4-[[(2-amino-1,4-dihydro-4-oxo-6-pteridinyl)amino]methyl]benzoyl]-

Systematic Name

English

FOLIC ACID HYDRATE IMPURITY C [EP IMPURITY]

Common Name

English

(2S)-2-[4-[[(2-amino-4-oxo-1,4-dihydropteridin-7-yl)methyl]amino]benzamido]pentanedioic acid

Common Name

English

Code System Code Type Description

PUBCHEM

135618534

Created by admin on Sat Dec 16 19:47:29 GMT 2023 , Edited by admin on Sat Dec 16 19:47:29 GMT 2023

PRIMARY

FDA UNII

EEA6VX2MJ7

Created by admin on Sat Dec 16 19:47:29 GMT 2023 , Edited by admin on Sat Dec 16 19:47:29 GMT 2023

PRIMARY

EPA CompTox

DTXSID80966993

Created by admin on Sat Dec 16 19:47:29 GMT 2023 , Edited by admin on Sat Dec 16 19:47:29 GMT 2023

PRIMARY

CAS

52560-13-1

Created by admin on Sat Dec 16 19:47:29 GMT 2023 , Edited by admin on Sat Dec 16 19:47:29 GMT 2023

PRIMARY

Related Record Type Details


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FOLIC ACID DIHYDRATE

PARENT -> IMPURITY

Amount: