Folate

• Folate
• bmse000299 - data

InCHi String:
InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t12-/m0/s1

canonical SMILES:
C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N


IUPAC: IUPAC openeye
(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid

IUPAC traditional
(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]benzoyl]amino]glutaric acid

IUPAC cas
(2S)-2-[[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]-oxo-methyl]amino]pentanedioic acid

IUPAC systematic
(2S)-2-[[4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]phenyl]carbonylamino]pentanedioic acid



PubChem Substance (SID):   85165103   148901   3787
PubChem Compound (CID):   6037
KEGG: Compound ID   C00504
CAS Registry IDs:   33609-88-0   59-30-3   6484-89-5   36653-55-1
PDB Chemical Component   FA   FOL
Miscellaneous Databases and IDs:   ChemIDplus 000059303   EINECS 200-419-0   CCRIS 666   HSDB 2002