CHEBI:58854 - 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1−)
ChEBI ID CHEBI:58854
ChEBI ASCII Name 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1-)
Definition An organophosphate oxoanion that is the conjugate base of 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate, arising from deprotonation of the phosphate OH.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C9H11N5O6P
Net Charge -1
Average Mass 316.18730
Monoisotopic Mass 316.04524
InChI InChI=1S/C9H12N5O6P/c10-9-13-7-5(8(16)14-9)12-3(1-11-7)6(15)4-2-19-21(17,18)20-4/h4,6,15H,1-2H2,(H,17,18)(H4,10,11,13,14,16)/p-1/t4-,6+/m1/s1
InChIKey QXDMVWOCXHMTPE-XINAWCOVSA-M
SMILES Nc1nc2NCC(=Nc2c(=O)[nH]1)[C@H](O)[C@H]1COP([O-])(=O)O1
ChEBI Ontology
Outgoing 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1−) (CHEBI:58854) is a organophosphate oxoanion (CHEBI:58945)
7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1−) (CHEBI:58854) is conjugate base of 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate (CHEBI:50972)
Incoming 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate (CHEBI:50972) is conjugate acid of 7,8-dihydro-D-neopterin 2',3'-cyclic phosphate(1−) (CHEBI:58854)
IUPAC Name
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-1,3,2-dioxaphospholan-2-olate 2-oxide
Synonyms Sources
(4R)-4-[(S)-(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)(hydroxy)methyl]-2-oxo-1,3,2λ5-dioxaphospholan-2-olate ChEBI
7,8-dihydroneopterin 2',3'-cyclic phosphate UniProt
Last Modified
18 March 2013