2H-Furo[3,2-d][1,3,2]oxazaphosphorin-7-ol,6-(6-amino-9H-purin-9-yl)hexahydro-2-hydroxy-,2-oxide,monosodium salt,[4as-(4aa,6b,7a,7ab)]-(9ci)

• CAS: 99443-14-8
• Catalog Number: ACM99443148
• Category: Other Products
• Molecular Weight: 350.2
• Molecular Formula: C₁₀H₁₃N₆O₅P.Na
• Synonyms: 3'-AMINO-3'-DEOXYADENOSINE-3',5'-CYCLIC MONOPHOSPHATE SODIUM SALT;3'-NH-CAMP SODIUM SALT;3'-aminoadenosine-3',5'-cyclicmonophosphate
• IUPAC Name: (4aS,6R,7R,7aS)-6-(6-aminopurin-9-yl)-2-hydroxy-2-oxo-1,4,4a,6,7,7a-hexahydrofuro[3,2-d][1,3,2]oxazaphosphinin-7-ol
• Canonical SMILES: C1C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)NP(=O)(O1)[O-].[Na+]
• InChI Key: IVOIKNCJCBUKRN-QYYRPYCUSA-N
• Exact Mass: 350.05000
• H-Bond Acceptor: 10
• H-Bond Donor: 4

Custom Q&A

What is the molecular formula of the compound with PubChem CID 90477948?

The molecular formula is C10H12N6NaO5P.

What is the molecular weight of the compound?

The molecular weight is 350.20 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is sodium;(4aS,6R,7R,7aS)-6-(6-aminopurin-9-yl)-2-oxido-2-oxo-1,4,4a,6,7,7a-hexahydrofuro[3,2-d][1,3,2]oxazaphosphinin-7-ol.

What is the InChIKey of the compound?

The InChIKey is HKLBACXTGFERHC-VVIREQCNSA-M.

How many hydrogen bond donor counts does the compound have?

The compound has 3 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does the compound have?

The compound has 10 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass is 350.05044878 g/mol.

How many heavy atoms are present in the compound?

There are 23 heavy atoms present in the compound.

Is the compound canonicalized?

Yes, the compound is canonicalized.

How many defined atom stereocenter counts does the compound have?

The compound has 4 defined atom stereocenter counts.