mitemcinal fumarate (CHEBI:751671)

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CHEBI:751671 - mitemcinal fumarate

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ChEBI ID	CHEBI:751671
ChEBI Name	mitemcinal fumarate
Stars
Last Modified	29 June 2026
Submitter	ChEMBL
Downloads	Molfile

Formula	C4H4O4.C40H69NO12
Net Charge	0
Average Mass	872.059
Monoisotopic Mass	871.49294
SMILES	CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C(C)C)[C@H]2O)[C@@]2(C)CC(C)=C(O2)[C@H](C)C(=O)[C@]1(C)OC.O=C(O)/C=C/C(=O)O
InChI	InChI=1S/C40H69NO12.C4H4O4/c1-16-28-40(12,47-15)33(43)23(6)31-21(4)18-39(11,53-31)35(52-37-30(42)27(17-22(5)48-37)41(13)20(2)3)24(7)32(25(8)36(45)50-28)51-29-19-38(10,46-14)34(44)26(9)49-29;5-3(6)1-2-4(7)8/h20,22-30,32,34-35,37,42,44H,16-19H2,1-15H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t22-,23+,24+,25-,26+,27+,28-,29+,30-,32+,34+,35-,37+,38-,39-,40-;/m1./s1
InChIKey	IDLXWTNPDREJQZ-HSOMBQIOSA-N

Roles Classification

gastrointestinal drug A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion.

ChEBI Ontology

Outgoing Relation(s)
	mitemcinal fumarate (CHEBI:751671) has role gastrointestinal drug (CHEBI:55324)
	mitemcinal fumarate (CHEBI:751671) is a carbonyl compound (CHEBI:36586)

Synonyms	Source
115-8543 JAPAN	ChEMBL
115-8543-JAPAN	ChEMBL
5-1 UKIMA 5 CHOME	ChEMBL
5-1-UKIMA-5-CHOME	ChEMBL
GM-611	ChEMBL
KITA-KU TOYKO	ChEMBL