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Pteroylglutamic acid

CAT: 0286-P28850-03Size: 500 gDry Ice: NoHazardous: No
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CAT#:0286-P28850-03Size:500 g
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CAS Number
59-30-3
Synonyms
PteGlu; Folic acid; Vitamin M; Folsan; Incafolic; Vitamin B9; N-[4-[[ (2-Amino-4-hydroxy-6-pteridyl) methyl]amino]
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00079305
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

Folic Acid

Folic acid is an N-acyl-amino acid that is a form of the water-soluble vitamin B9. Its biologically active forms (tetrahydrofolate and others) are essential for nucleotide biosynthesis and homocysteine remethylation. It has a role as a nutrient, a mouse metabolite and a human metabolite. It is a member of folic acids and a N-acyl-amino acid. It is functionally related to a pteroic acid. It is a conjugate acid of a folate(2-).

CAS Number59-30-3
PubChem CID135398658
IUPAC Name(2S)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
Molecular FormulaC19H19N7O6
Molecular Weight441.4
XLogP-1.1
Topological Polar Surface Area209
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Heavy Atom Count32
Formal Charge0
Complexity767
SMILES
C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)NC(=N3)N
InChI
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
InChIKey
OVBPIULPVIDEAO-LBPRGKRZSA-N
Chemical Structure
2D Structure
2D structure of Folic Acid
CAS: 59-30-3
CID: 135398658
Formula: C19H19N7O6
MW: 441.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight441.4
XLogP3-1.1
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Exact Mass441.13968135
Monoisotopic Mass441.13968135
Topological Polar Surface Area209 Ų
Heavy Atom Count32
Formal Charge0
Complexity767
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
F5800-10AFolic Acid (Vitamin B9, Pteroylglutamic acid) discontinued
MBS6128664-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (HRP)
MBS6126807-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (APC)
MBS6126190-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (AP)
MBS6128042-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (FITC)
MBS6129283-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (PE)
MBS641106-01Folic Acid (Vitamin B9, Pteroylglutamic acid) USP
MBS6248961-01Folic Acid (Vitamin B9, Pteroylglutamic acid) (Biotin)
F5800-12A-FITCFolic Acid (Vitamin B9, Pteroylglutamic acid) (FITC) discontinued
F5800-12C-BiotinFolic Acid (Vitamin B9, Pteroylglutamic acid) (Biotin) discontinued

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