CAS 148608-53-1 | Cytidine, 5-formyl- | CAS Number 148608-53-1

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148608-53-1 | Cytidine, 5-formyl-

CAS No: 148608-53-1 Catalog No: AG001L2H MDL No:

Product Description

Catalog Number:

AG001L2H

Chemical Name:

Cytidine, 5-formyl-

CAS Number:

148608-53-1

Molecular Formula:

C10H13N3O6

Molecular Weight:

271.2267

IUPAC Name:

4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidine-5-carbaldehyde

InChI:

InChI=1S/C10H13N3O6/c11-8-4(2-14)1-13(10(18)12-8)9-7(17)6(16)5(3-15)19-9/h1-2,5-7,9,15-17H,3H2,(H2,11,12,18)/t5-,6-,7-,9-/m1/s1

InChI Key:

OCMSXKMNYAHJMU-JXOAFFINSA-N

SMILES:

OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cc(C=O)c(nc1=O)N

Properties

Complexity:

462

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

271.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.229g/mol

Monoisotopic Mass:

271.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

146A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.2

Literature

Title	Journal
Thymine DNA glycosylase can rapidly excise 5-formylcytosine and 5-carboxylcytosine: potential implications for active demethylation of CpG sites.	The Journal of biological chemistry 20111014
The human mitochondrial tRNAMet: structure/function relationship of a unique modification in the decoding of unconventional codons.	Journal of molecular biology 20110218