AG00AR2H

Name: BAR 502
Brand: Angene Chemical
SKU: AG00AR2H

1612191-86-2 | BAR 502

AG00AR2H

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CAS Number	1612191-86-2
Catalog Number	AG00AR2H
Chemical Name	BAR 502
IUPAC Name	(5S,8S,9R,10S,13R,14S,17R)-6-ethyl-17-(4-hydroxybutan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
InChI	InChI=1S/C25H44O3/c1-5-17-21-14-16(27)8-11-25(21,4)20-9-12-24(3)18(15(2)10-13-26)6-7-19(24)22(20)23(17)28/h15-23,26-28H,5-14H2,1-4H3/t15?,16?,17?,18-,19+,20-,21+,22+,23?,24-,25-/m1/s1
InChI Key	HYCMOIGNYNCMRH-BNVZFTBUSA-N
MDL Number	MFCD31381922
Molecular Formula	C25H44O3
Molecular Weight	392.6151
SMILES	CC[C@@H]3[C@@H]1C[C@H](O)CC[C@@](C)1[C@H]2CC[C@@]4(C)[C@@H](CC[C@@H]4[C@@H](CCO)C)[C@@]([H])2[C@@H]3O
Synonyms	BAR 502, 1612191-86-2, EX-A1734, ACN-037537,

Complexity	564
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	7
Defined Bond Stereocenter Count	0
Exact Mass	392.329g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	392.624g/mol
Monoisotopic Mass	392.329g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	60.7A^2
Undefined Atom Stereocenter Count	4
Undefined Bond Stereocenter Count	0
XLogP3	5.5

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