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Folcysteine

CAT: 0013-GTR19199210-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19199210-01Size:25 mg
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Description
Folcysteine is a cysteine-based derivative investigated as a potential antitumor agent due to its role in folate metabolism, supporting DNA synthesis, repair, and methylation. It serves as a cofactor in biochemical reactions and is utilized in cancer research for both in vitro and in vivo experimental studies.
CAS Number
8064-47-9
Field of Research
Metabolism Research
Smiles
CC (=O) N1CSC[C@H]1C (O) =O.Nc1nc2[nH]cc (CNc3ccc (cc3) C (=O) N[C@@H] (CCC (O) =O) C (O) =O) nc2c (=O) n1
Molecular Formula
C25H28N8O9S
Molecular Weight
616.60
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

L-Glutamic acid, N-(4-(((2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, mixt. with (4R)-3-acetyl-4-thiazolidinecarboxylic acid

used to promote fertility in chickens

CAS Number8064-47-9
PubChem CID135618615
IUPAC Name(4R)-3-acetyl-1,3-thiazolidine-4-carboxylic acid;(2S)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
Molecular FormulaC25H28N8O9S
Molecular Weight616.6
Topological Polar Surface Area292
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count14
Rotatable Bond Count10
Heavy Atom Count43
Formal Charge0
Complexity962
SMILES
CC(=O)N1CSC[C@H]1C(=O)O.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.C6H9NO3S/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;1-4(8)7-3-11-2-5(7)6(9)10/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30);5H,2-3H2,1H3,(H,9,10)/t12-;5-/m00/s1
InChIKey
VYRZTJJEGHJETR-OEFIRVHCSA-N
Chemical Structure
2D Structure
2D structure of L-Glutamic acid, N-(4-(((2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl)amino)benzoyl)-, mixt. with (4R)-3-acetyl-4-thiazolidinecarboxylic acid
CAS: 8064-47-9
CID: 135618615
Formula: C25H28N8O9S
MW: 616.6
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight616.6
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count14
Rotatable Bond Count10
Exact Mass616.16999567
Monoisotopic Mass616.16999567
Topological Polar Surface Area292 Ų
Heavy Atom Count43
Formal Charge0
Complexity962
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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