MYX

(2Z,6E)-7-{2'-[(2E,4E)-1,6-DIMETHYLHEPTA-2,4-DIENYL]-2,4'-BI-1,3-THIAZOL-4-YL}-3,5-DIMETHOXY-4-METHYLHEPTA-2,6-DIENAMID E

Created:	2004-03-29
Last modified:	2020-06-05

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2 entries where MYX is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	66
Chiral Atom Count	3
Bond Count	67
Aromatic Bond Count	11

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Chemical Component Summary
Name	(2Z,6E)-7-{2'-[(2E,4E)-1,6-DIMETHYLHEPTA-2,4-DIENYL]-2,4'-BI-1,3-THIAZOL-4-YL}-3,5-DIMETHOXY-4-METHYLHEPTA-2,6-DIENAMID E
Synonyms	7-[2'-(1,6-DIMETHYL-HEPTA-2,4-DIENYL)-[2,4']BITHIAZOLYL-4-YL]-3,5-DIMETHOXY-4-METHYL-HEPTA-2,6-DIENOIC ACID AMIDE; MYXOTHIAZOL
Systematic Name (OpenEye OEToolkits)	(2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-[2-[2-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl]-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]hepta-2,6-dienamide
Formula	C₂₅ H₃₃ N₃ O₃ S₂
Molecular Weight	487.678
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(N)\C=C(\OC)C(C)C(OC)/C=C/c1nc(sc1)c2nc(sc2)C(\C=C\C=C\C(C)C)C
SMILES	CACTVS	3.385	CO[CH](C=Cc1csc(n1)c2csc(n2)[CH](C)C=CC=CC(C)C)[CH](C)C(OC)=CC(N)=O
SMILES	OpenEye OEToolkits	1.7.5	CC(C)C=CC=CC(C)c1nc(cs1)c2nc(cs2)C=CC(C(C)C(=CC(=O)N)OC)OC
Canonical SMILES	CACTVS	3.385	CO[C@@H](\C=C\c1csc(n1)c2csc(n2)[C@@H](C)\C=C\C=C\C(C)C)[C@@H](C)C(\OC)=C/C(N)=O
Canonical SMILES	OpenEye OEToolkits	1.7.5	C[C@@H](/C=C/C=C/C(C)C)c1nc(cs1)c2nc(cs2)/C=C/[C@@H]([C@@H](C)/C(=C\C(=O)N)/OC)OC
InChI	InChI	1.03	InChI=1S/C25H33N3O3S2/c1-16(2)9-7-8-10-17(3)24-28-20(15-33-24)25-27-19(14-32-25)11-12-21(30-5)18(4)22(31-6)13-23(26)29/h7-18,21H,1-6H3,(H2,26,29)/b9-7+,10-8+,12-11+,22-13+/t17-,18+,21-/m0/s1
InChIKey	InChI	1.03	XKTFQMCPGMTBMD-FYHMSGCOSA-N

Drug Info: DrugBank

DrugBank ID	DB04741
Name	Myxothiazol
Groups	experimental
Synonyms	Myxothiazol A Myxothiazol (+)-myxothiazol
Categories	Acids, Acyclic Acrylates Anti-Infective Agents Antifungal Agents Electron Transport Complex III, antagonists & inhibitors Enzyme Inhibitors Sulfur Compounds
CAS number	76706-55-3

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Cytochrome b-c1 complex subunit 1, mitochondrial	MAASVVCRAATAGAQVLLRARRSPALLRTPALRSTATFAQALQFVPETQV...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682