mometasone (CHEBI:6970)

CHEBI:6970 - mometasone

Formula	C22H28Cl2O4
Net Charge	0
Average Mass	427.368
Monoisotopic Mass	426.13646
SMILES	[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)C=C[C@@]21C
InChI	InChI=1S/C22H28Cl2O4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-17,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1
InChIKey	QLIIKPVHVRXHRI-CXSFZGCWSA-N

Roles Classification

vasoconstrictor agent Drug used to cause constriction of the blood vessels.

dermatologic drug A drug used to treat or prevent skin disorders or for the routine care of skin.

anti-allergic agent A drug used to treat allergic reactions.

anti-inflammatory drug A substance that reduces or suppresses inflammation.

ChEBI Ontology

Outgoing Relation(s)
	mometasone (CHEBI:6970) has functional parent Δ¹-progesterone (CHEBI:34073)
	mometasone (CHEBI:6970) has role anti-allergic agent (CHEBI:50857)
	mometasone (CHEBI:6970) has role anti-inflammatory drug (CHEBI:35472)
	mometasone (CHEBI:6970) has role dermatologic drug (CHEBI:50177)
	mometasone (CHEBI:6970) has role vasoconstrictor agent (CHEBI:50514)
	mometasone (CHEBI:6970) is a 11β-hydroxy steroid (CHEBI:35346)
	mometasone (CHEBI:6970) is a 17α-hydroxy steroid (CHEBI:35342)
	mometasone (CHEBI:6970) is a 20-oxo steroid (CHEBI:36885)
	mometasone (CHEBI:6970) is a 3-oxo-Δ¹,Δ⁴-steroid (CHEBI:77166)
	mometasone (CHEBI:6970) is a chlorinated steroid (CHEBI:77175)
	mometasone (CHEBI:6970) is a tertiary α-hydroxy ketone (CHEBI:139592)
Incoming Relation(s)
Incoming Relation(s)	mometasone furoate (CHEBI:47564) has functional parent mometasone (CHEBI:6970)

IUPAC Name
9,21-dichloro-11β,17-dihydroxy-16α-methylpregna-1,4-diene-3,20-dione

Synonyms	Source
(+)-Mometasone	ChemIDplus
Mometasone	KEGG COMPOUND

Registry Numbers	Sources
CAS:105102-22-5	KEGG COMPOUND
CAS:105102-22-5	ChemIDplus