Structure

Doramectin

CAS
117704-25-3
Catalog Number
ACM117704253
Category
Inhibitors
Molecular Weight
899.11
Molecular Formula
C50H74O14

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Specification

Description
Doramectin is a derivative of Ivermectin (HY-15310). Doramectin is a potent antiparasitic antibiotic. Doramectin is an active compound against S.mansoni in an NMRI mouse infection model.
Synonyms
25-CYCLOHEXYL-5-O-DEMETHYL-25-DE(1-METHYLPROPYL)AVERMECTIN;DORAMECTIN;Doramectin VETRANAL;Doromectin;_x00B_25-Cclohexyl-avermectin B1;25-Cyclohexyl-5-O-demethyl-25-de(1-methylpropyl)avermectin A1A;Dectoma;UK-67994
Canonical SMILES
CO[C@@H]1[C@@H](O[C@]2([H])O[C@@H](C)[C@H](O)[C@@H](OC)C2)[C@H](C)O[C@@]([H])(O[C@H](/C(C)=C/C[C@]3([H])C[C@]([H])(OC4=O)C[C@]5(C=C[C@H](C)[C@@H](C6CCCCC6)O5)O3)[C@@H](C)/C=C/C=C7CO[C@@]8([H])[C@]\7(O)[C@@]4([H])C=C(C)[C@H]8O)C1
Melting Point
116-1190C
Appearance
Solid
Storage
-20°C, protect from light*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light).
Hazard Statements
T,N,Xi
Safety Description
33-45-60-61-36/37-26
Shipping
Can be shipped at room temperature, where not in use may vary.
Source
S. avermitilis TG2002
Supplemental Hazard Statements
H301-H410
Symbol
GHS06,GHS09
What is the molecular formula of Doramectin?

The molecular formula of Doramectin is C50H74O14.

What is the molecular weight of Doramectin?

The molecular weight of Doramectin is 899.1 g/mol.

When was Doramectin created?

Doramectin was created on October 25, 2006.

What is the approved use of Doramectin?

Doramectin is approved by the FDA for the treatment of parasites in cattle, such as gastrointestinal roundworms, lungworms, eyeworms, grubs, sucking lice, and mange mites.

What is the IUPAC name of Doramectin?

The IUPAC name of Doramectin is (1'R,2R,3S,4'S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-2-cyclohexyl-21',24'-dihydroxy-12'-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-3,11',13',22'-tetramethylspiro[2,3-dihydropyran-6,6'-3,7,19-trioxatetracyclo[15.6.1.1 4,8 .0 20,24 ]pentacosa-10,14,16,22-tetraene]-2'-one.

What is the InChIKey of Doramectin?

The InChIKey of Doramectin is QLFZZSKTJWDQOS-YDBLARSUSA-N.

What is the Canonical SMILES of Doramectin?

The Canonical SMILES of Doramectin is CC1C=CC=C2COC3C2(C(C=C(C3O)C)C(=O)OC4CC(CC=C(C1OC5CC(C(C(O5)C)OC6CC(C(C(O6)C)O)OC)OC)C)OC7(C4)C=CC(C(O7)C8CCCCC8)C)O.

What is the CAS number of Doramectin?

The CAS number of Doramectin is 117704-25-3.

What is the UNII of Doramectin?

The UNII of Doramectin is KGD7A54H5P.

Is Doramectin listed in Wikipedia?

Yes, Doramectin is listed in Wikipedia.

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