m6A (N6-methyladenosine)

CAT: 0244-S3190-50mgSize: 50 mgDry Ice: NoHazardous: No

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CAT#:0244-S3190-50mgSize:50 mg

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CAS Number

1867-73-8

Chemical Information

N6-Methyladenosine

N(6)-methyladenosine is a methyladenosine compound with one methyl group attached to N6 of the adenine nucleobase.

CAS Number	1867-73-8
PubChem CID	102175
IUPAC Name	(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]oxolane-3,4-diol
Molecular Formula	C11H15N5O4
Molecular Weight	281.27
XLogP	-0.4
Topological Polar Surface Area	126
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Heavy Atom Count	20
Formal Charge	0
Complexity	349

SMILES

CNC1=C2C(=NC=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O

InChI

InChI=1S/C11H15N5O4/c1-12-9-6-10(14-3-13-9)16(4-15-6)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11,17-19H,2H2,1H3,(H,12,13,14)/t5-,7-,8-,11-/m1/s1

InChIKey

VQAYFKKCNSOZKM-IOSLPCCCSA-N

Chemical Structure

2D Structure

CAS: 1867-73-8

CID: 102175

Formula: C11H15N5O4

MW: 281.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	281.27
XLogP3	-0.4
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	281.11240398
Monoisotopic Mass	281.11240398
Topological Polar Surface Area	126 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	349
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