CHEBI:144940 - L-alanyl-AMP zwitterion

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name L-alanyl-AMP zwitterion
ChEBI ID CHEBI:144940
ChEBI ASCII Name L-alanyl-AMP zwitterion
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information ZINC000013776853
Download Molfile XML SDF
Formula C13H19N6O8P
Net Charge 0
Average Mass 418.303
Monoisotopic Mass 418.10020
InChI InChI=1S/C13H19N6O8P/c1-5(14)13(22)27-28(23,24)25-2-6-8(20)9(21)12(26-6)19-4-18-7-10(15)16-3-17-11(7)19/h3-6,8-9,12,20-21H,2,14H2,1H3,(H,23,24)(H2,15,16,17)/t5-,6+,8+,9+,12+/m0/s1
InChIKey ISYFCRWDMNBLTM-MACXSXHHSA-N
SMILES N1(C2=C(C(=NC=N2)N)N=C1)[C@@H]3O[C@H](COP([O-])(OC([C@H](C)[NH3+])=O)=O)[C@H]([C@H]3O)O
ChEBI Ontology
Outgoing L-alanyl-AMP zwitterion (CHEBI:144940) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
L-alanyl-AMP zwitterion (CHEBI:144940) is a zwitterion (CHEBI:27369)
L-alanyl-AMP zwitterion (CHEBI:144940) is enantiomer of D-alanyl-AMP zwitterion (CHEBI:138619)
Incoming D-alanyl-AMP zwitterion (CHEBI:138619) is enantiomer of L-alanyl-AMP zwitterion (CHEBI:144940)
Synonym Source
L-alanyl-5'-AMP UniProt
Manual Xref Database
CPD-18588 MetaCyc accession
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