AG009E6V

Name: 1-Cyclopropane mycophenolic acid
Brand: Angene Chemical
SKU: AG009E6V

125198-40-5 | 1-Cyclopropane mycophenolic acid

AG009E6V

SDS

COA

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CAS Number	125198-40-5
Catalog Number	AG009E6V(AGN-PC-0WHA7M)
Chemical Name	1-Cyclopropane mycophenolic acid
IUPAC Name	3-[2-[(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)methyl]-1-methylcyclopropyl]propanoic acid
InChI	InChI=1S/C18H22O6/c1-9-12-8-24-17(22)14(12)15(21)11(16(9)23-3)6-10-7-18(10,2)5-4-13(19)20/h10,21H,4-8H2,1-3H3,(H,19,20)
InChI Key	QVUZLDOXUBRWHS-UHFFFAOYSA-N
Molecular Formula	C18H22O6
Molecular Weight	334.3637
SMILES	COc1c(C)c2COC(=O)c2c(O)c1CC3CC3(C)CCC(=O)O
Synonyms	CHEMBL168861, 1-Cyclopropane Mycophenolic Acid, 125198-40-5, SCHEMBL20595269, BDBM50010602, 3-[(4-Hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl)methyl]-1-methylcyclopropane-1-propionic acid, 3-[2-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-ylmethyl)-1-methyl-cyclopropyl]-propionic acid, QVUZLDOXUBRWHS-UHFFFAOYSA-N,

Complexity	520
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	334.142g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	334.368g/mol
Monoisotopic Mass	334.142g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	93.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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