ivarmacitinib sulfate (CHEBI:758964)

CHEBI:758964 - ivarmacitinib sulfate

Formula	H2O4S.C18H22N8O2S
Net Charge	0
Average Mass	512.574
Monoisotopic Mass	512.12602
SMILES	O=S(=O)(O)O.[H][C@@]12C[C@@H](N(C)c3ncnc4nccc34)C[C@]1([H])CN(C(=O)Nc1nc(OC)ns1)C2
InChI	InChI=1S/C18H22N8O2S.H2O4S/c1-25(15-13-3-4-19-14(13)20-9-21-15)12-5-10-7-26(8-11(10)6-12)18(27)23-17-22-16(28-2)24-29-17;1-5(2,3)4/h3-4,9-12H,5-8H2,1-2H3,(H,19,20,21)(H,22,23,24,27);(H2,1,2,3,4)/t10-,11+,12+;
InChIKey	XVVWQCLRGHYWPI-OOWXMNGOSA-N

Roles Classification

antirheumatic drug A drug used to treat rheumatoid arthritis.

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

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

anti-inflammatory agent Any compound that has anti-inflammatory effects.

ChEBI Ontology

Outgoing Relation(s)
	ivarmacitinib sulfate (CHEBI:758964) has role anti-inflammatory agent (CHEBI:67079)
	ivarmacitinib sulfate (CHEBI:758964) has role antineoplastic agent (CHEBI:35610)
	ivarmacitinib sulfate (CHEBI:758964) has role antirheumatic drug (CHEBI:35842)
	ivarmacitinib sulfate (CHEBI:758964) has role dermatologic drug (CHEBI:50177)
	ivarmacitinib sulfate (CHEBI:758964) is a pyrrolopyrimidine (CHEBI:38670)