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(2'OMe-5'p-m6A) pG

CAT: 0804-HY-178543Size: 1 EachDry Ice: NoHazardous: No
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Description
(2'OMe-5'p-m6A) pG is a monomeric raw material that can be used for nucleic acid synthesis.
CAS Number
1207283-40-6
UNSPSC
12352005
Target
Nucleoside Antimetabolite/Analog
Related Pathways
Cell Cycle/DNA Damage
Field of Research
Metabolic Disease
Smiles
OP(OC[C@H]1O[C@@H](N2C3=NC=NC(NC)=C3N=C2)[C@H](OC)[C@@H]1OP(OC[C@H]4O[C@@H](N5C6=C(C(N=C(N6)N)=O)N=C5)[C@H](O)[C@@H]4O)(O)=O)(O)=O
Molecular Formula
C22H30N10O14P2
Molecular Weight
720.48
Shipping Conditions
Room temperature
Scientific Category
Oligonucleotides
Clinical Information
No Development Reported

Chemical Information

(2'OMe-5'p-m6A)pG
CAS Number1207283-40-6
PubChem CID168301110
IUPAC Name[(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [(2R,3R,4R,5R)-4-methoxy-5-[6-(methylamino)purin-9-yl]-2-(phosphonooxymethyl)oxolan-3-yl] hydrogen phosphate
Molecular FormulaC22H30N10O14P2
Molecular Weight720.5
XLogP-5.7
Topological Polar Surface Area332
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count20
Rotatable Bond Count12
Heavy Atom Count48
Formal Charge0
Complexity1320
SMILES
CNC1=C2C(=NC=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C5N=C(NC6=O)N)O)O)OC
InChI
InChI=1S/C22H30N10O14P2/c1-24-16-10-17(26-5-25-16)31(6-27-10)21-15(41-2)14(9(45-21)4-42-47(36,37)38)46-48(39,40)43-3-8-12(33)13(34)20(44-8)32-7-28-11-18(32)29-22(23)30-19(11)35/h5-9,12-15,20-21,33-34H,3-4H2,1-2H3,(H,39,40)(H,24,25,26)(H2,36,37,38)(H3,23,29,30,35)/t8-,9-,12-,13-,14-,15-,20-,21-/m1/s1
InChIKey
ZSLVBXJFRJQSDL-NAGRZYTCSA-N
Chemical Structure
2D Structure
2D structure of (2'OMe-5'p-m6A)pG
CAS: 1207283-40-6
CID: 168301110
Formula: C22H30N10O14P2
MW: 720.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight720.5
XLogP3-5.7
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count20
Rotatable Bond Count12
Exact Mass720.14181966
Monoisotopic Mass720.14181966
Topological Polar Surface Area332 Ų
Heavy Atom Count48
Formal Charge0
Complexity1320
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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