edelinontrine (CHEBI:754834)

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CHEBI:754834 - edelinontrine

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ChEBI ID	CHEBI:754834
ChEBI Name	edelinontrine
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C20H25N7O2
Net Charge	0
Average Mass	395.467
Monoisotopic Mass	395.20697
SMILES	C[C@@H]1CN(Cc2ncccn2)C[C@H]1c1nc(=O)c2cnn(C3CCOCC3)c2n1
InChI	InChI=1S/C20H25N7O2/c1-13-10-26(12-17-21-5-2-6-22-17)11-16(13)18-24-19-15(20(28)25-18)9-23-27(19)14-3-7-29-8-4-14/h2,5-6,9,13-14,16H,3-4,7-8,10-12H2,1H3,(H,24,25,28)/t13-,16-/m1/s1
InChIKey	IWXUVYOOUMLUTQ-CZUORRHYSA-N

Roles Classification

cardiovascular drug A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.

ChEBI Ontology

Outgoing Relation(s)
	edelinontrine (CHEBI:754834) has role cardiovascular drug (CHEBI:35554)
	edelinontrine (CHEBI:754834) is a pyrazolopyrimidine (CHEBI:38669)

INNs	Source
edelinontrina	WHO MedNet
edelinontrine	WHO MedNet

Synonyms	Source
Crd-740	ChEMBL
CRD740	ChEMBL
Pf-04447943	ChEMBL
PF04447943	ChEMBL
PF-4447943	ChEMBL
PF4447943	ChEMBL

Citations