AG008ZUQ

Name: NSC-12
Brand: Angene Chemical
SKU: AG008ZUQ

102586-30-1 | NSC-12

AG008ZUQ

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CAS Number	102586-30-1
Catalog Number	AG008ZUQ(AGN-PC-0ORP3D)
Chemical Name	NSC-12
IUPAC Name	4,4,4-trifluoro-1-[(3S,8S,9S,10R,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-(trifluoromethyl)butane-1,3-diol
InChI	InChI=1S/C24H34F6O3/c1-20-9-7-14(31)11-13(20)3-4-15-16-5-6-18(21(16,2)10-8-17(15)20)19(32)12-22(33,23(25,26)27)24(28,29)30/h3,14-19,31-33H,4-12H2,1-2H3/t14-,15-,16-,17-,18+,19?,20-,21-/m0/s1
InChI Key	OHKBOEWLASAFLW-STFFYOTPSA-N
MDL Number	MFCD31544308
Molecular Formula	C24H34F6O3
Molecular Weight	484.5154
SMILES	O[C@H](C1)CC[C@@]2(C)C1=CC[C@]3([H])[C@]2([H])CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])C(O)CC(O)(C(F)(F)F)C(F)(F)F
Synonyms	CHEMBL3819333, NSC 172285, NSC12, NSC-12, 102586-30-1, BDBM50182286, s7940, AKOS032945162,

Complexity	778
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	7
Defined Bond Stereocenter Count	0
Exact Mass	484.241g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	484.523g/mol
Monoisotopic Mass	484.241g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	60.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	6

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