Analyte Name

5-(alpha-Folinilamido) Tetrahydrofolic Acid

Molecular Formula

C39 H44 N14 O12

Molecular Weight

900.853

Accurate Mass

900.326

SMILES

NC1=NC(=O)C2=C(NCC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(=O)N4C(CNc5ccc(cc5)C(=O)N[C@@H](CCC(=O)O)C(=O)O)CNC6=C4C(=O)N=C(N)N6)C(=O)O)N2C=O)N1

InChI

InChI=1S/C39H44N14O12/c40-38-48-30-28(34(60)50-38)52(17-54)22(14-44-30)13-42-20-5-1-18(2-6-20)32(58)46-24(36(62)63)9-11-26(55)53-23(16-45-31-29(53)35(61)51-39(41)49-31)15-43-21-7-3-19(4-8-21)33(59)47-25(37(64)65)10-12-27(56)57/h1-8,17,22-25,42-43H,9-16H2,(H,46,58)(H,47,59)(H,56,57)(H,62,63)(H,64,65)(H4,40,44,48,50,60)(H4,41,45,49,51,61)/t22?,23?,24-,25-/m0/s1

IUPAC

(2S)-2-[[4-[[2-amino-5-[(4S)-4-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]-4-carboxybutanoyl]-4-oxo-1,6,7,8-tetrahydropteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat