CHEBI:60869 - (3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine
ChEBI ID CHEBI:60869
ChEBI ASCII Name (3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine
Definition An organic phosphoramidate that is 5'-O-[amino(3-aminopropoxy)phosphoryl]adenosine in which the nitrogen of the phosphoramidite is acylated by a (2S)-2-amino-3-carboxypropanoyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Harold Drabkin
Supplier Information
Download Molfile XML SDF
Formula C17H27N8O9P
Net Charge 0
Average Mass 518.41820
Monoisotopic Mass 518.16386
InChI InChI=1S/C17H27N8O9P/c18-2-1-3-32-35(31,24-16(30)8(19)4-10(26)27)33-5-9-12(28)13(29)17(34-9)25-7-23-11-14(20)21-6-22-15(11)25/h6-9,12-13,17,28-29H,1-5,18-19H2,(H,26,27)(H2,20,21,22)(H,24,30,31)/t8-,9+,12+,13+,17+,35?/m0/s1
InChIKey CBRVFFLBHDTTIM-AYDCQREWSA-N
SMILES NCCCOP(=O)(NC(=O)[C@@H](N)CC(O)=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
ChEBI Ontology
Outgoing (3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine (CHEBI:60869) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
(3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine (CHEBI:60869) is a nucleotide-amino acid (CHEBI:48116)
(3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine (CHEBI:60869) is a organic phosphoramidate (CHEBI:37773)
IUPAC Name
5'-O-[(3-aminopropoxy)(L-α-aspartylamino)phosphoryl]adenosine
Synonym Source
(3-aminopropyl)(L-aspartyl-1-amino)phosphoryl-5'-adenosine SUBMITTER
Manual Xref Database
AA0328 RESID
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Last Modified
25 July 2012