Cordycepin, cordycepin, cordycepin structure

Cordycepin, cordycepin, cordycepin

[2-(6-aminopurin-9-yl)-5-[[[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methyl hydrogen phosphate

Also Known As: Co-Co-Co (Co = Cordycepin)|Cordycepin, cordycepin, cordycepin|2',5'-Oligocordycepin|Cordycepin,cordycepin,cordycepin|Adenosine, 3'-deoxyadenylyl-(2'.5')-3'-deoxyadenylyl-(2'.5')-3'-deoxy-|[2-(6-aminopurin-9-yl)-5-[[[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methyl hydrogen phosphate

CAS: 76885-99-9
Molecular Formula C30H37N15O13P2
Molecular Weight 877.21704 g/mol
LogP -4.6
Topological Polar Surface Area 389.0 Ų
Hydrogen Bond Donors 7
Hydrogen Bond Acceptors 25
Rotatable Bonds 14
Exact Mass 877.21704
Monoisotopic Mass 877.21704
Heavy Atoms 60
Complexity 1590.0

Chemical Identifiers

CAS Number 76885-99-9
SMILES C1C(OC(C1OP(=O)(O)OCC2CC(C(O2)N3C=NC4=C(N=CN=C43)N)OP(=O)(O)OCC5CC(C(O5)N6C=NC7=C(N=CN=C76)N)O)N8C=NC9=C(N=CN=C98)N)CO
InChIKey CKZWLFLXOQDVEX-UHFFFAOYSA-N

Product Overview

Cordycepin, cordycepin, cordycepin (CAS 76885-99-9), with molecular formula C30H37N15O13P2 and molecular weight 877.21704 g/mol. IUPAC: [2-(6-aminopurin-9-yl)-5-[[[2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolan-3-yl]oxy-hydroxyphosphoryl]oxymethyl]oxolan-3-yl] [5-(6-aminopurin-9-yl)-4-hydroxyoxolan-2-yl]methyl hydrogen phosphate.

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