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Nemadectin - >95%, high purity , CAS No.102130-84-7

    Grade & Purity:
  • ≥95%
In stock
Item Number
N329392
Grouped product items
SKU Size
Availability
Price Qty
N329392-1mg
1mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$280.90
N329392-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$893.90

a broad-spectrum endectocidal and nematocidal antibiotic

Basic Description

Synonyms FEMA 2882 | 1Y8VJ1G3TY | Nemadectine | UNII-1Y8VJ1G3TY | (R)-2-Hydroxypropionsaeure | NEMADECTIN [INN] | Q27253169 | UNII-798V2T7ZBV | (6R,23S,25S)-5-O-Demethyl-28-deoxy-25-((E)-1,3-dimethyl-1-butenyl)-6,28-epoxy-23-hydroxymilbemycin B | Nemadectin [USAN:
Specifications & Purity ≥95%
Storage Temp Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Product Description

Nemadectin, initially described as LL-F28249-a, is a macrocyclic lactone antibiotic demonstrating broad-spectrum endectocidal and nematocidal activity. Nemadectin bears structural similarity to the milbemycin and avermectin antibiotics, differing by the unsaturated side-chain extending from the 6,6-spiroketal core of the antibiotic. Nemadectin has demonstrated efficacy against the natural canine-infecting helminths and against ivermectin-resistant|Haemonchus contortus|in sheep.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Macrolides and analogues
Subclass Milbemycins
Intermediate Tree Nodes Not available
Direct Parent Milbemycins
Alternative Parents Ketals  Oxanes  Tertiary alcohols  Oxolanes  Secondary alcohols  Lactones  Carboxylic acid esters  Polyols  Oxacyclic compounds  Monocarboxylic acids and derivatives  Dialkyl ethers  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular Framework Aliphatic heteropolycyclic compounds
Substituents Milbemycin - Ketal - Oxane - Oxolane - Tertiary alcohol - Carboxylic acid ester - Lactone - Secondary alcohol - Polyol - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Alcohol - Carbonyl group - Aliphatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as milbemycins. These are a group of macrolides with a structure containing a 16-membered lactone ring fused to a 1,7-dioxaspiroundecane ring system and to either a benzofuran (or hydrogenated derivative thereof). In some cases (e.g. Milbemycin E), the tetrahydrofuranyl ring is missing. Milbemycins can be o-glycosylated at C13 to form Avermectins. Milbemycins are produced by Streptomyces species.
External Descriptors Not available

Product Properties

pKa pKₐ: 12.46 (Predicted)

Names and Identifiers

IUPAC Name (1R,4S,4'S,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-4',21,24-trihydroxy-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one
INCHI InChI=1S/C36H52O8/c1-20(2)13-24(6)32-25(7)30(37)18-35(44-32)17-28-16-27(43-35)12-11-22(4)14-21(3)9-8-10-26-19-41-33-31(38)23(5)15-29(34(39)42-28)36(26,33)40/h8-11,13,15,20-21,25,27-33,37-38,40H,12,14,16-19H2,1-7H3/b9-8+,22-11+,24-13+,26-10+/t21-,25-,27+,28-,29-,30-,31+,32+,33+,35-,36+/m0/s1
InChIKey YNFMRVVYUVPIAN-AQUURSMBSA-N
Smiles CC1CC(=CCC2CC(CC3(O2)CC(C(C(O3)C(=CC(C)C)C)C)O)OC(=O)C4C=C(C(C5C4(C(=CC=C1)CO5)O)O)C)C
Isomeric SMILES C[C@@H]\1C/C(=C/C[C@@H]2C[C@@H](C[C@@]3(O2)C[C@@H]([C@@H]([C@H](O3)/C(=C/C(C)C)/C)C)O)OC(=O)[C@@H]4C=C([C@H]([C@@H]5[C@]4(/C(=C/C=C1)/CO5)O)O)C)/C
PubChem CID 6436124
Molecular Weight 612.8

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Solubility Soluble in water (poor), ethanol, methanol, DMSO, and DMF.
Refractive Index n20D1.58 (Predicted)
Boil Point(°C) ~789.4° C at 760 (Predicted)
Molecular Weight 612.800 g/mol
XLogP3 4.000
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 2
Exact Mass 612.366 Da
Monoisotopic Mass 612.366 Da
Topological Polar Surface Area 115.000 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 1240.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 11
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 4
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 4
Covalently-Bonded Unit Count 1

Solution Calculators

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