Adenylyl-(2'→5')-cytidine

AlkaPlorer ID: AK283328

Synonym: Cytidylyl-(5'→2')-adenosine

IUPAC Name: [5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate

Structure

SMILES: NC1=NC(=O)N(C2OC(COP(=O)(O)OC3C(O)C(CO)OC3N3C=NC4=C(N)N=CN=C43)C(O)C2O)C=C1

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InChI: InChI=1S/C19H25N8O11P/c20-9-1-2-26(19(32)25-9)17-13(31)11(29)8(37-17)4-35-39(33,34)38-14-12(30)7(3-28)36-18(14)27-6-24-10-15(21)22-5-23-16(10)27/h1-2,5-8,11-14,17-18,28-31H,3-4H2,(H,33,34)(H2,20,25,32)(H2,21,22,23)

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InChIKey: URZNAIZQTLTEJZ-UHFFFAOYSA-N

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Reference

PubChem CID: 5236784

CAS: 10318-62-4

Properties Information

Molecule Weight: 572.4280000000002

TPSA: 285.67

MolLogP: -3.3803999999999954

Number of H-Donors: 7

Number of H-Acceptors: 18

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information