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5-methyltetrahydrofolic acid (CHEBI:15641)

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ChEBI Name 5-methyltetrahydrofolic acid
ChEBI ID CHEBI:15641
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12146, CHEBI:2097
Supplier Information
See structure as:  Image  Applet
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Formulae Sources
C20H25N7O6 KEGG COMPOUND
C20H25N7O6 ChEBI
Net Charge 0
Average Mass 459.45580
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-STQMWFEESA-N
SMILES
CN1[C@@H](CNc2ccc(cc2)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CNc2nc(N)[nH]c(=O)c12
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more on the ChEBI Ontology
ChEBI Ontology
Outgoing 5-methyltetrahydrofolic acid (CHEBI:15641) is a tetrahydrofolic acid (CHEBI:26907)
5-methyltetrahydrofolic acid (CHEBI:15641) is conjugate acid of 5-methyltetrahydrofolate(2−) (CHEBI:18608)
Incoming 5-methyltetrahydrofolyl polyglutamate macromolecule (CHEBI:63907) has functional parent 5-methyltetrahydrofolic acid (CHEBI:15641)
5-methyltetrahydrofolate(2−) (CHEBI:18608) is conjugate base of 5-methyltetrahydrofolic acid (CHEBI:15641)
IUPAC Name
N-[4-({[(6S)-2-amino-5-methyl-4-oxo-3,4,5,6,7,8-hexahydropteridin-6-yl]methyl}amino)benzoyl]-L-glutamic acid
Synonyms Sources
5-Methyltetrahydrofolate KEGG COMPOUND
[(6S)-5-methyl-5,6,7,8-tetrahydropteroyl]glutamate ChEBI
N-(5-methyl-5,6,7,8-tetrahydropteroyl)-L-glutamic acid ChEBI
Database Links Databases
C00007252 KNApSAcK
C00440 KEGG COMPOUND
DB04789 DrugBank
View more database links
Registry Number Type Source
134-35-0 CAS Registry Number KEGG COMPOUND
General Comment
2004-01-09 The naturally occurring compound is the 6S stereoisomer.
 
Last Modified
04 August 2014

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