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MEDRYSONE

CAS No.:
2668-66-8
Catalog Number:
AG00BE2E
Molecular Formula:
C22H32O3
Molecular Weight:
344.4877
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥95%
1 week
United States
$93
- +
250mg
≥95%
1 week
United States
$121
- +
500mg
≥95%
1 week
United States
$175
- +
Product Description
Catalog Number:
AG00BE2E
Chemical Name:
MEDRYSONE
CAS Number:
2668-66-8
Molecular Formula:
C22H32O3
Molecular Weight:
344.4877
MDL Number:
MFCD00056477
IUPAC Name:
(6S,8S,9S,10R,11S,13S,14S,17S)-17-acetyl-11-hydroxy-6,10,13-trimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
InChI:
InChI=1S/C22H32O3/c1-12-9-15-17-6-5-16(13(2)23)22(17,4)11-19(25)20(15)21(3)8-7-14(24)10-18(12)21/h10,12,15-17,19-20,25H,5-9,11H2,1-4H3/t12-,15-,16+,17-,19-,20+,21-,22+/m0/s1
InChI Key:
GZENKSODFLBBHQ-ILSZZQPISA-N
SMILES:
O=C1CC[C@]2(C(=C1)[C@@H](C)C[C@@H]1[C@@H]2[C@@H](O)C[C@]2([C@H]1CC[C@@H]2C(=O)C)C)C
EC Number:
220-208-7
UNII:
D2UFC189XF
NSC Number:
63278
Properties
Complexity:
650  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
8  
Defined Bond Stereocenter Count:
0
Exact Mass:
344.235g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
344.495g/mol
Monoisotopic Mass:
344.235g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Gene expression-based chemical genomics identifies potential therapeutic drugs in hepatocellular carcinoma. PloS one 20110101
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Little evidence for association of the glaucoma gene MYOC with open-angle glaucoma. The British journal of ophthalmology 20100501
[Effects of electroacupuncture of Sanyinjiao (SP 6) on genito-endocrine in patients with perimenopausal syndrome]. Zhen ci yan jiu = Acupuncture research 20070801
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Behavioral and neurochemical effects on rat offspring after prenatal exposure to ethanol. Neurotoxicology and teratology 20050101
Properties