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AG01FNZS

203312-38-3 | Spirotetramat-enol

AG01FNZS

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CAS Number	203312-38-3
Catalog Number	AG01FNZS(AGN-PC-0QTMTU)
Chemical Name	Spirotetramat-enol
EC Number	606-522-0
IUPAC Name	3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one
InChI	InChI=1S/C18H23NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,20H,6-9H2,1-3H3,(H,19,21)
InChI Key	IDJJHEIUIYGFDX-UHFFFAOYSA-N
MDL Number	MFCD18071431
Molecular Formula	C18H23NO3
Molecular Weight	301.3801
SMILES	CO[C@@H]1CC[C@@]2(CC1)NC(=O)C(=C2O)c3cc(C)ccc3C
UNII	R36PCD908V
Synonyms	Spirotetramat-enol, UNII-R36PCD908V, 203312-38-3, R36PCD908V, Cis-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro(4.5)dec-3-en-2-one, 3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one, cis-3-(2,5-Dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one, SCHEMBL143382, SCHEMBL143383, SCHEMBL10071973, SCHEMBL12778725, SCHEMBL13227442, DTXSID90716123, CHEBI:141400, IDJJHEIUIYGFDX-UHFFFAOYSA-N, ZINC101326965, 1-Azaspiro(4.5)dec-3-en-2-one, 3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-, cis-, Spirotetramat Metabolite BYI08330-cis-enol, Spirotetramat Metabolite BYI08330-cis-enol solution, (5s,8s)-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one, 2-(2,5-dimethylphenyl)-1-hydroxy-8-methoxy-4-azaspiro[4.5]dec-1-en-3-one, cis-3-(2,5-dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4,5]dec-3-en-2-one, cis-3-(2,5-Dimethylphenyl)-4-hydroxy-8-methoxy-1-azaspiro[4.5]dec-3-en-2-one solution, CID11381071, 3-(2,5-dimethylphenyl)-2-hydroxy-8-methoxy-1-azaspiro[4.5]dec-2-en-4-one,

Complexity	477
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	301.168g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	301.386g/mol
Monoisotopic Mass	301.168g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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CERTIFICATE OF ANALYSIS

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Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

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Angene International Limited