AG001LG9

1492-18-8 | L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt (1:1)

AG001LG9

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CAS Number	1492-18-8
Catalog Number	AG001LG9(AGN-PC-0Q2Z5V)
Chemical Name	L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt (1:1)
EC Number	216-082-8
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
MDL Number	MFCD00149463
Molecular Formula	C20H21CaN7O7
Molecular Weight	511.5014
SMILES	O=CN2c(c(NCC2CNc3ccc(C(N[C@H](C([O-])=O)CCC([O-])=O)=O)cc3)[nH]c(N)n1)c1=O.[Ca+2]
Synonyms	5 Formyltetrahydrofolate, 5 Formyltetrahydropteroylglutamate, 5-Formyltetrahydrofolate, 5-Formyltetrahydropteroylglutamate, Acid, Folinic, Calcium Folinate, Calcium Leucovorin, Citrovorum Factor, Factor, Citrovorum, Folinate, Calcium, Folinic Acid, Folinic Acid SF, Folinic Acid-SF, Leucovorin, Leucovorin, (D)-Isomer, Leucovorin, (DL)-Isomer, Leucovorin, (R)-Isomer, Leucovorin, Calcium, Leucovorin, Calcium (1:1) Salt, Leucovorin, Calcium (1:1) Salt, (DL)-Isomer, Leucovorin, Calcium (1:1) Salt, Pentahydrate, Leucovorin, Monosodium Salt, Leukovorin, Leukovorum, Monosodium Salt Leucovorin, N(5)-Formyltetrahydrofolate, Wellcovorin, calcium folinate, LEUCOVORIN CALCIUM, Wellcovorin, Folinic acid calcium salt, Folinate-SF Calcium, Lederfoline, Leucovorin calcium salt, Calcium leucovorin, 1492-18-8, Folinic acid (Calcium), Calcium levofolinate, Leucovorin calcium preservative free, Calcii folinas [INN-Latin], Folinic acid-SF, calcium salt, Calcium citrovorum factor, Calcium folinatc, Calcium 5-formyltetrahydrofolate, Folinato calcico [INN-Spanish], Folinate de calcium [INN-French], (+)-L-Folinic acid, calcium salt, NSC 3590, EINECS 216-082-8, Leucovorin calcium [USP], LEVOLEUCOVORIN CALCIUM, 80433-71-2, Leucovorin calcium (USP), Calcium N-(p-((((6RS)-2-amino-5-formyl-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)methyl)amino)benzoyl)-L-glutamate (1:1), Rescuvolin, Folidan, 6035-45-6, Calcii folinas, Folinato calcico, 5-Formyl-5,6,7,8-tetrahydrofolic acid calcium salt, Calcium L-folinate, Citrovorum factor, calcium (2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate, Folinate de calcium, Glutamic acid, N-(p-(((2-amino-5-formyl-5,6,7,8-tetrahydro-3-hydroxy-6-pteridinyl)methyl)amino)benzoyl)-, calcium salt (1:1), L-, L-Glutamic acid, N-(4-(((2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, calcium salt (1:1), Leucovorin Calcium [USAN], calcium-folinate, Wellcovorin (TN), calcium;(2S)-2-[[4-[(2-amino-5-formyl-4-oxo-1,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioate, Prestwick_224, Uzel (TN), Calcium Folinate, USP, Calcium folinate [INN], AC1L9FEF, Calcium folinate (JP17), SCHEMBL18573, SPECTRUM1500364, C20H21N7O7.Ca, AC1L259Q, CHEMBL1201138, CHEBI:31340, HMS500L04, AOB5605, BIC0607, DTXSID20872448, KVUAALJSMIVURS-ZEDZUCNESA-L, HMS1570C18, HMS1920J05, HMS2091P21, HMS2097C18, HMS3714C18, Calcium folinate(Leucovorin Calcium), CCG-38930, AKOS015894859, AKOS032949578, AC-7456, AN-9009, CS-1363, RL01892, AS-13746, HY-13664, LS-71774, FT-0603241, FT-0603561, FT-0654951, D01211, F-7000, I06-116, Levoleucovorin, Elvorine, Isovorin, Fusilev, folinic acid, Calciumlevofolinate, UNII-RPR1R4C0P4, D0B6TW, UNII-R3W57OBQ5W, RPR1R4C0P4, UNII-778XL6VBS8, C20H21CaN7O7, Leucovorin calcium pentahydrate, Levoleucovorin calcium [USAN], Calcium folinate, 98% 250mg, C20H23N7O7.Ca.5H2O, C20-H21-Ca-N7-O7, C20-H21-N7-O7.Ca, CID15150, MFCD00006704, Folinic acid calcium salt pentahydrate, CS-O-06253, C20-H23-N7-O7.Ca.5H2-O, C2235, CL 307,782, Folinic acid calcium salt hydrate, 98% - 1G 1g, Calcium N-(p-((((6S)-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-L-glutamate (1:1), Glutamic acid, N-[p-[[(2-amino-5-formyl-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt (1:1), L-, Glutamic acid, N-[p-[[(2-amino-5-formyl-5,6,7,8-tetrahydro-4-hydroxy-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt, pentahydrate, L-, L-Glutamic acid, N-(4-(((2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, calcium salt (1:1), pentahydrate, L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt (1:1), L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt (1:1), pentahydrate, L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt(1:1), L-Glutamic acid, N-[4-[[(2-amino-5-formyl-1,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-, calcium salt(1:1), pentahydrate,

Complexity	900
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	511.113g/mol
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	511.508g/mol
Monoisotopic Mass	511.113g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	221A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

Lot Number