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Nimocetine

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Nimocetine / CAS : 102130-84-7

Appearance White solid UN 2588
HS 29420000 DG Class 6.1(b)
Synonyms (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; Nemadectina; Nemadectine; Nemadectinum
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Properties

Summary

Formula
C36H52O8
Molecular Mass
612.79300
Exact Mass
612.36600
PSA
114.68000
Logp
5.08740
IUPAC
(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
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

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Antiparasitic Drugs

Chemical and Physical Properties

Density
1.20±0.1 g/cm3(Predicted)
Boiling Point
789.4±60.0 °C(Predicted)
Appearance
White solid
Acidity and Basicity
acidness

Export information

HS Code
29420000
Export Rebate
13%
UN No.
2588
DG-Class
6.1(b)

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