N-Methyltetrahydrofolic acid

CAT: 0926-FM16122-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0926-FM16122-01Size:25 g

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CAS Number

134-35-0

Synonyms

5-Methyltetrahydrofolic acid; L-Methyl folate

Smiles

CN1C (CNC2=C1C (=O) NC (=N2) N) CNC3=CC=C (C=C3) C (=O) N[C@@H] (CCC (=O) O) C (=O) O

Molecular Formula

C20H25N7O6

Molecular Weight

459.46 g/mol

Controlled

Chemical Information

5-Methyltetrahydrofolic acid

5-methyltetrahydrofolic acid is a methylated derivate of tetrahydrofolate. It is generated by methylenetetrahydrofolate reductase from 5,10-methylenetetrahydrofolate and used to recycle homocysteine back to methionine by 5-methyltetrahydrofolate-homocysteine methyltransferases (also called methionine synthases).

CAS Number	134-35-0
PubChem CID	135415868
IUPAC Name	(2S)-2-[[4-[(2-amino-5-methyl-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
Molecular Formula	C20H25N7O6
Molecular Weight	459.5
XLogP	-0.5
Topological Polar Surface Area	198
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	9
Heavy Atom Count	33
Formal Charge	0
Complexity	865

SMILES

CN1C(CNC2=C1C(=O)NC(=N2)N)CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C20H25N7O6/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31)/t12?,13-/m0/s1

InChIKey

ZNOVTXRBGFNYRX-ABLWVSNPSA-N

Chemical Structure

2D Structure

CAS: 134-35-0

CID: 135415868

Formula: C20H25N7O6

MW: 459.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	459.5
XLogP3	-0.5
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	9
Exact Mass	459.18663154
Monoisotopic Mass	459.18663154
Topological Polar Surface Area	198 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	865
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
GX7429-5g	N-Methyltetrahydrofolic acid
M23504-01	5-Methyltetrahydrofolic acid
HY-137829-01	5-Methyltetrahydrofolic acid (disodium)
A18916-500	5-Methyltetrahydrofolic acid 500mg
HY-113046S1	5-Methyltetrahydrofolic acid-13C6
HY-113046S	5-Methyltetrahydrofolic acid-13C5
A18916-100	5-Methyltetrahydrofolic acid 100mg
A18916-50	5-Methyltetrahydrofolic acid 50mg
HY-113046R-01	5-Methyltetrahydrofolic acid (Standard)
sc-352780	5-Methyltetrahydrofolic acid calcium salt

N-Methyltetrahydrofolic acid

Chemical Information

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