AG002AEQ

Name: Estrone Enol Diacetate
Brand: Angene Chemical
SKU: AG002AEQ

20592-42-1 | Estrone Enol Diacetate

AG002AEQ

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CAS Number	20592-42-1
Catalog Number	AG002AEQ(AGN-PC-0O7JVU)
Chemical Name	Estrone Enol Diacetate
EC Number	243-899-7
IUPAC Name	[(8R,9S,13S,14S)-3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate
InChI	InChI=1S/C22H26O4/c1-13(23)25-16-5-7-17-15(12-16)4-6-19-18(17)10-11-22(3)20(19)8-9-21(22)26-14(2)24/h5,7,9,12,18-20H,4,6,8,10-11H2,1-3H3/t18-,19-,20+,22+/m1/s1
InChI Key	KPJNGUPMJAHAND-JBPLPALLSA-N
MDL Number	MFCD00136092
Molecular Formula	C22H26O4
Molecular Weight	354.4394
SMILES	CC(=O)OC1=CC[C@H]2[C@@H]3CCc4cc(OC(=O)C)ccc4[C@H]3CC[C@]12C
Synonyms	Estrone enol diacetate, 20592-42-1, Estra-1,3,5(10),16-tetraene-3,17-diol diacetate, 1,3,5(10),16-Estratetraene-3,17-diol diacetate, SCHEMBL8519574, Estra-1,3,5(10),16-tetraene-3,17-diol, diacetate, CTK1A4623, KPJNGUPMJAHAND-JBPLPALLSA-N, 17-(Acetyloxy)estra-1(10),2,4,16-tetraen-3-yl acetate #, Estra-1,3,5(10),16-tetraene-3,17-diol, 3,17-diacetate, EINECS 243-899-7, C22-H26-O4, estra-1,3,5 ,16-tetraene-3,17-dioldiacetate, (3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopen,

Complexity	624
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	354.183g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	354.446g/mol
Monoisotopic Mass	354.183g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.5

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