Terminology Service for NFDI4Health
JSON

7-deaza-8-chloro-cAMP

Go to external page http://purl.obolibrary.org/obo/CHEBI_84611

A nucleoside 3',5'-cyclic phosphate that is 7-deaza-cAMP substituted at position 8 by a chloro group.

Term info

Label

7-deaza-8-chloro-cAMP

Synonyms
  • (4aR,6R,7R,7aS)-6-(4-amino-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-2,7-dihydroxytetrahydro-2H,4H-2lambda(5)-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
database cross reference
Subsets

3_STAR

IUPAC NAME
(4aR,6R,7R,7aS)-6-(4-amino-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-2,7-dihydroxytetrahydro-2H,4H-2lambda(5)-furo[3,2-d][1,3,2]dioxaphosphinin-2-one [ IUPAC ]

charge

0

formula

C11H12ClN4O6P

has obo namespace

chebi_ontology

has related synonym

7-deaza-8-chloroadenosine cyclic 3',5'-phosphate, 8-Cl-7-CH-cAMP, 7-deaza-8-chloro-3',5'-cyclic AMP

id

CHEBI:84611

inchi

InChI=1S/C11H12ClN4O6P/c12-6-1-4-9(13)14-3-15-10(4)16(6)11-7(17)8-5(21-11)2-20-23(18,19)22-8/h1,3,5,7-8,11,17H,2H2,(H,18,19)(H2,13,14,15)/t5-,7-,8-,11-/m1/s1

inchikey

OXPRCSNQDJNURK-IOSLPCCCSA-N

mass

362.66300

monoisotopicmass

362.01830

smiles

Nc1ncnc2n([C@@H]3O[C@@H]4COP(O)(=O)O[C@H]4[C@H]3O)c(Cl)cc12