AG00DDV5

SDS

COA

TIP This product is typically in stock.Please contact us for quotation.

Request For Quotation

CAS Number	53552-05-9
Catalog Number	AG00DDV5(AGN-PC-071DSB)
Chemical Name	(−)-Bicuculline methochloride
IUPAC Name	(6S)-6-[(5R)-6,6-dimethyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-6-ium-5-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one;chloride
InChI	InChI=1S/C21H20NO6.ClH/c1-22(2)6-5-11-7-15-16(26-9-25-15)8-13(11)18(22)19-12-3-4-14-20(27-10-24-14)17(12)21(23)28-19;/h3-4,7-8,18-19H,5-6,9-10H2,1-2H3;1H/q+1;/p-1/t18-,19+;/m1./s1
InChI Key	RLJKFAMYSYWMND-VOMIJIAVSA-M
MDL Number	MFCD00078981
Molecular Formula	C21H20ClNO6
Molecular Weight	417.8396
SMILES	O=C(O1)C2=C(C=CC3=C2OCO3)[C@@]1([H])[C@@]4([H])C5=CC6=C(OCO6)C=C5CC[N+]4(C)C.[Cl-]
Synonyms	(-)-BICUCULLINE METHOCHLORIDE, 53552-05-9, AKOS030530541, C-56235, (R)-6,6-dimethyl-5-((S)-8-oxo-6,8-dihydroisobenzofuro[5,4-d][1,3]dioxol-6-yl)-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium chloride, -BICUCULLINEMETHOCHLORIDE,

Complexity	655
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	417.098g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	417.842g/mol
Monoisotopic Mass	417.098g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	63.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

Product Recommendations

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited