N(6)-carboxymethyl-5'-AMP
Basic information
- CAS
77133-59-6- Standard SMILES
O=C(O)CNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O- InChIKey
WLOAEWNLYCRMGZ-JJNLEZRASA-N- Molecular formula
- C12H16N5O9P
- Average molar mass
- 405.26 g/mol
- Monoisotopic mass
- 405.0685641
Overview
5'-AMP antigens synthesized by conjugating with serum albumin
Names & identifiers
- Preferred name
- N(6)-carboxymethyl-5'-AMP
- IUPAC
- 2-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl]amino]acetic acid
- English name
- N(6)-carboxymethyl-5'-AMP
- Molecular formula
- C12H16N5O9P
- Molecular weight
- 405.26
Names & synonyms
NcmampN(6)-Carboxymethyl-5'-amp77133-59-6N(6)-Carboxymethyl-5'-adenosine monophosphateDTXSID00227912Glycine, N-(9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purin-6-yl)-RefChem:160763DTXCID501504032-[[9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl]amino]acetic acidSCHEMBL32685380[(9-{(2R,3R,4S,5R)-3,4-Dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}-9H-purin-6-yl)amino]acetic acidGlycine, N-[9-(5-O-phosphono-β-D-ribofuranosyl)-9H-purin-6-yl]-
Database identifiers
- CAS
77133-59-6- PubChem CID
- 196487
- DTXSID
DTXSID00227912
Properties
Computed structural properties
- XLogP
- -3.3
- Topological polar surface area
- 209 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 594
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Compound notes
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