Pemetrexed L-Glutamic Acid Trisodium Salt

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H25N6O9.3Na
Molecular Weight	622.4701
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Pemetrexed L-Glutamic Acid Trisodium Salt

Structure Search

SMILES

[Na+].[Na+].[Na+].NC1=NC(=O)C2=C(NC=C2CCC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC([O-])=O)C([O-])=O)C([O-])=O)N1

InChI

InChIKey=WUUKQGFDPJBYPJ-XYTXGRHFSA-K

InChI=1S/C25H28N6O9.3Na/c26-25-30-20-19(22(36)31-25)14(11-27-20)6-3-12-1-4-13(5-2-12)21(35)29-16(24(39)40)7-9-17(32)28-15(23(37)38)8-10-18(33)34;;;/h1-2,4-5,11,15-16H,3,6-10H2,(H,28,32)(H,29,35)(H,33,34)(H,37,38)(H,39,40)(H4,26,27,30,31,36);;;/q;3*+1/p-3/t15-,16-;;;/m0.../s1

HIDE SMILES / InChI

Molecular Formula	C25H25N6O9
Molecular Weight	553.5008
Charge	-3
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
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 `Wed Apr 02 17:30:47 GMT 2025` Edited by `admin` on `Wed Apr 02 17:30:47 GMT 2025`
Record UNII	B429MAG8AK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Pemetrexed L-Glutamic Acid Trisodium Salt

Common Name

English

L-Glutamic acid, N-[4-[2-(2-amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-L-?-glutamyl-, trisodium salt

Preferred Name

English

Code System Code Type Description

PUBCHEM

137034782

Created by admin on Wed Apr 02 17:30:47 GMT 2025 , Edited by admin on Wed Apr 02 17:30:47 GMT 2025

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CAS

1265908-59-5

Created by admin on Wed Apr 02 17:30:47 GMT 2025 , Edited by admin on Wed Apr 02 17:30:47 GMT 2025

PRIMARY

FDA UNII

B429MAG8AK

Created by admin on Wed Apr 02 17:30:47 GMT 2025 , Edited by admin on Wed Apr 02 17:30:47 GMT 2025

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PEMETREXED GLUTAMIDE

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Amount: