lymecycline (CHEBI:59040)

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CHEBI:59040 - lymecycline

ChEBI ID	CHEBI:59040
ChEBI Name	lymecycline
Stars
Definition	A tetracycline-based broad-spectrum antibiotic. It is approximately 5000 times more soluble than tetracycline base and is unique amongst tetracyclines in that it is absorbed by the "active transport" process across the intestinal wall.
Last Modified	7 February 2018
Submitter	Steve
Downloads	Molfile

Formula	C29H38N4O10
Net Charge	0
Average Mass	602.641
Monoisotopic Mass	602.25879
SMILES	[H][C@]12C[C@@]3([H])[C@H](N(C)C)C(O)=C(C(=O)NCNCCCC[C@H](N)C(=O)O)C(=O)[C@@]3(O)C(O)=C1C(=O)c1c(O)cccc1[C@@]2(C)O
InChI	InChI=1S/C29H38N4O10/c1-28(42)13-7-6-9-17(34)18(13)22(35)19-14(28)11-15-21(33(2)3)23(36)20(25(38)29(15,43)24(19)37)26(39)32-12-31-10-5-4-8-16(30)27(40)41/h6-7,9,14-16,21,31,34,36-37,42-43H,4-5,8,10-12,30H2,1-3H3,(H,32,39)(H,40,41)/t14-,15-,16-,21-,28+,29-/m0/s1
InChIKey	AHEVKYYGXVEWNO-UEPZRUIBSA-N

Wikipedia

Roles Classification

Biological Roles:

antiprotozoal drug Any antimicrobial drug which is used to treat or prevent protozoal infections.

antibacterial drug A drug used to treat or prevent bacterial infections.

protein synthesis inhibitor A compound, usually an anti-bacterial agent or a toxin, which inhibits the synthesis of a protein.

antimicrobial agent A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Applications:

antiprotozoal drug Any antimicrobial drug which is used to treat or prevent protozoal infections.

antibacterial drug A drug used to treat or prevent bacterial infections.

ChEBI Ontology

Outgoing Relation(s)
	lymecycline (CHEBI:59040) has role antibacterial drug (CHEBI:36047)
	lymecycline (CHEBI:59040) has role antimicrobial agent (CHEBI:33281)
	lymecycline (CHEBI:59040) has role antiprotozoal drug (CHEBI:35820)
	lymecycline (CHEBI:59040) has role protein synthesis inhibitor (CHEBI:48001)
	lymecycline (CHEBI:59040) is a tertiary α-hydroxy ketone (CHEBI:139592)
	lymecycline (CHEBI:59040) is a tetracyclines (CHEBI:26895)

IUPAC Name
N⁶-[({[(4S,4aS,5aS,6S,12aS)-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracen-2-yl]carbonyl}amino)methyl]-L-lysine

INNs	Source
lymecycline	KEGG DRUG
limeciclina	ChemIDplus
lymecyclinum	ChemIDplus

Synonyms	Source
N²-(((+)-5-Amino-5-carboxypentylamino)methyl)tetracycline	ChemIDplus
N-Lysinomethyltetracycline	ChemIDplus
N6-((4-(Dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamido)methyl)lysine	ChemIDplus
Tetracycline-L-methylene lysine	ChemIDplus
Tetracycline-L-methylenelysine	ChemIDplus
(+)-N-(5-Amino-5-carboxypentylaminomethyl)-4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxonaphthacene-2-carboxamide	ChemIDplus

Manual Xrefs	Databases
D06884	KEGG DRUG
DB00256	DrugBank
Lymecycline	Wikipedia
1619	DrugCentral

Registry Numbers	Sources
Reaxys:15428429	Reaxys
CAS:992-21-2	KEGG DRUG
CAS:992-21-2	ChemIDplus

Citations