Myxothiazol

CAT: 0024-sc-507550Size: 1 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-507550Size:1 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

76706-55-3

Chemical Information

Myxothiazol

Thenoyltrifluoroacetone is an organic molecular entity. It has a role as a chelator and an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor.

CAS Number	76706-55-3
PubChem CID	10972974
IUPAC Name	(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
Molecular Formula	C25H33N3O3S2
Molecular Weight	487.7
XLogP	4.8
Topological Polar Surface Area	144
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	12
Heavy Atom Count	33
Formal Charge	0
Complexity	738

SMILES

C[C@@H](/C=C/C=C/C(C)C)C1=NC(=CS1)C2=NC(=CS2)/C=C/[C@@H]([C@@H](C)/C(=C\C(=O)N)/OC)OC

InChI

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

XKTFQMCPGMTBMD-FYHMSGCOSA-N

Chemical Structure

2D Structure

CAS: 76706-55-3

CID: 10972974

Formula: C25H33N3O3S2

MW: 487.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	487.7
XLogP3	4.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	12
Exact Mass	487.19633427
Monoisotopic Mass	487.19633427
Topological Polar Surface Area	144 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	738
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	4
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
T68731-01	Myxothiazol

Myxothiazol

Chemical Information

Alternative Products

Popular Products