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

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

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

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

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

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	KEGG COMPOUND
(+)-Mometasone	ChemIDplus

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