CHEBI:190462 - dfPreQ1 monophosphate

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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 dfPreQ1 monophosphate
ChEBI ID CHEBI:190462
Definition 2'-deoxy-7-formylaminomethyl-7-deazaguanosine 5'-monophosphate
Stars This entity has been manually annotated by a third party.
Submitter Geoffrey Hutinet
Supplier Information
Download Molfile XML SDF
Formula C13H14N5O8P
Net Charge -2
Average Mass 399.257
Monoisotopic Mass 399.05910
InChI InChI=1S/C13H16N5O8P/c14-13-16-11-10(12(21)17-13)6(2-15-5-19)3-18(11)9-1-7(20)8(26-9)4-25-27(22,23)24/h1,3,5,8-9,20H,2,4H2,(H,15,19)(H2,22,23,24)(H3,14,16,17,21)/p-2
InChIKey VWUYOPLTSZBOKR-UHFFFAOYSA-L
SMILES C1(C2=C(N=C(N1)N)N(C=C2CNC=O)C3OC(C(=C3)O)COP(=O)([O-])[O-])=O
ChEBI Ontology
Outgoing dfPreQ1 monophosphate (CHEBI:190462) is a organic molecular entity (CHEBI:50860)