Analytenname

Pemetrexed L-Glutamic Acid Trisodium Salt

CAS-Nummer

1265908-59-5

Molekularformel

C25 H25 N6 O9 . 3 Na

Molekulargewicht

622.47

Genaue Masse

622.1376

SMILES

[Na+].[Na+].[Na+].NC1=NC(=O)c2c(CCc3ccc(cc3)C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])C(=O)[O-])c[nH]c2N1

InChI

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

IUPAC

trisodium;(2S)-2-[[(4S)-4-[[4-[2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]-4-carboxylatobutanoyl]amino]pentanedioate

Abweichende CAS-Nummer

Free acid: 144051-68-3

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Impurity

Produktformat

Neat

API-Familie

Pemetrexed