Basic information
- CAS
120229-04-1- Standard SMILES
C[C@H]1OC(n2c(N=[N+]=[N-])nc3c(N)ncnc32)[C@H](OOP(=O)(O)O)[C@@H]1Oc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
CUPZSIZRCJXUIS-GVZFETOISA-M- Molecular formula
- C16H14N11O13P
- Average molar mass
- 599.3 g/mol
- Monoisotopic mass
- 599.05101654
Overview
affinity probe for the Ca+-ATPase of sarcoplasmic reticulum; RN given refers to the 8-(14C)-labeled cpd
Names & identifiers
- Preferred name
- 2',3'-O-(2,4,6-trinitrophenyl)-8-azidoadenosine monophosphate
- IUPAC
- [(3R,4R,5R)-2-(6-amino-8-azidopurin-9-yl)-5-methyl-4-(2,4,6-trinitrophenoxy)oxolan-3-yl]oxy dihydrogen phosphate
- English name
- 2',3'-O-(2,4,6-trinitrophenyl)-8-azidoadenosine monophosphate
- Molecular formula
- C16H13N11O13P
- Molecular weight
- 600.31
Names & synonyms
2,3-Tpaamp2',3'-O-(2,4,6-Trinitrophenyl)-8-azidoadenosine monophosphate120229-04-1RefChem:800722',3'-O-(2,4,6-TRINITROPHENYL)-8-AZIDOADENOSINE M...
Database identifiers
- CAS
120229-04-1- PubChem CID
- 129088
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 316 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 19
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,080
Chemistry & industry
Suppliers1 total
Alfa Chemistry+1-5166625404 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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