2’-C-Methyl-5-fluorouridine

CAT: 0926-FM144517-01Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0926-FM144517-01Size:2 mg

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CAS Number

23643-38-1

MDL Number

MFCD27921023

Smiles

C[C@]1 ([C@@H] ([C@H] (O[C@H]1N2C=C (C (=O) NC2=O) F) CO) O) O

Molecular Formula

C10H13FN2O6

Molecular Weight

276.22 g/mol

Controlled

Chemical Information

2'-C-methyl-5-fluorouridine

CAS Number	23643-38-1
PubChem CID	67175601
IUPAC Name	1-[(2R,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]-5-fluoropyrimidine-2,4-dione
Molecular Formula	C10H13FN2O6
Molecular Weight	276.22
XLogP	-2
Topological Polar Surface Area	119
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	455

SMILES

C[C@]1([C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)F)CO)O)O

InChI

InChI=1S/C10H13FN2O6/c1-10(18)6(15)5(3-14)19-8(10)13-2-4(11)7(16)12-9(13)17/h2,5-6,8,14-15,18H,3H2,1H3,(H,12,16,17)/t5-,6-,8-,10-/m1/s1

InChIKey

JJGOHYAJPJNPOC-LTNPLRIYSA-N

Chemical Structure

2D Structure

CAS: 23643-38-1

CID: 67175601

Formula: C10H13FN2O6

MW: 276.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	276.22
XLogP3	-2
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	276.07576430
Monoisotopic Mass	276.07576430
Topological Polar Surface Area	119 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	455
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
ND02921-01	2'-Deoxy-5-fluorouridine
NF04076-01	5-Fluorouridine
CDA18080-01	5-Fluorouridine
ND145456	2'-Deoxy-2'-fluorouridine-5'-monophosphate
ND02968-01	5'-Deoxy-5-fluorouridine
ND08228-01	2'-Deoxy-5'-O-DMT-5-fluorouridine
ND138640	4',5'-Didehydro-2',5'-dideoxy-2'-fluorouridine
ND06064-01	2'-Deoxy-5'-O-DMT-2'-fluorouridine
ND09528-01	2'-Deoxy-2'-fluorouridine-5'-triphosphate tetralithium
NF31489	5-Fluorouridine-5'-diphosphate sodium

Catalog	Name
HY-152749	2’-β-C-Methyl-5-fluorouridine
MBS5825811	5'-C-Methyl-5-fluorouridine
MBS5817002	5'(R)-C-Methyl-5-fluorouridine
GTR19220643-01	5' (R) -C-Methyl-5-fluorouridine
HY-152783	5’ (R) -C-Methyl-5-fluorouridine
HY-154061	2’,3’,5’-Tri-O-benzoyl-2’-β-C-methyl-5-fluorouridine
TNU0221-01	3'-Deoxy-3'-a-C-methyl-5-fluorouridine
HY-152412	3’-Deoxy-3’-α-C-methyl-5-fluorouridine
TRC-F532521-25MG	5-Fluorouridine 5'-Triphosphate-¹³C
MBS3604031-01	5-Fluorouridine