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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Avermectin A1a, 25-cyclohexyl-5-O-demethyl-25-de(1-methylpropyl)-

CO[C@H]1C[C@@H](O[C@H]([C@@H]1O[C@H]1C[C@H](OC)[C@H]([C@@H](O1)C)O)C)O[C@H]1[C@@H](C)/C=C/C=C/2CO[C@H]3[C@]2(O)[C@@H](C=C([C@H]3O)C)C(=O)O[C@H]2C[C@@H](C/C=C/1C)O[C@]1(C2)C=C[C@@H]([C@H](O1)C1CCCCC1)C Request for Quotation
Chemical Name: Avermectin A1a, 25-cyclohexyl-5-O-demethyl-25-de(1-methylpropyl)-
CAS Number: 117704-25-3
Product Number: AG0038B9(AGN-PC-0PAWIV)
Synonyms:
MDL No:
Molecular Formula: C50H74O14
Molecular Weight: 899.1142

Identification/Properties

Computed Properties
Molecular Weight:
899.128g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
14
Rotatable Bond Count:
7
Exact Mass:
898.508g/mol
Monoisotopic Mass:
898.508g/mol
Topological Polar Surface Area:
170A^2
Heavy Atom Count:
64
Formal Charge:
0
Complexity:
1790
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
19
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H410
Precautionary Statements:
P273-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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