Catalog Number:
AG001LG9
Chemical Name:
5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt hydrate
CAS Number:
1492-18-8
Molecular Formula:
C20H21CaN7O7
Molecular Weight:
511.5014
MDL Number:
MFCD00149463
IUPAC Name:
calcium;(2S)-2-[[4-[(2-amino-5-formyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
InChI:
InChI=1S/C20H23N7O7.Ca/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);/q;+2/p-2/t12?,13-;/m0./s1
InChI Key:
KVUAALJSMIVURS-ZEDZUCNESA-L
SMILES:
O=CN1C(CNc2ccc(cc2)C(=O)N[C@H](C(=O)[O-])CCC(=O)[O-])CNc2c1c(=O)nc([nH]2)N.[Ca+2]
EC Number:
216-082-8
