Name: Name:11-BETA,17-ALPHA,21-TRIHYDROXY-5-ALPHA-PREGNANE-3,20-DIONE
Brand: Angene
SKU: AG00DFDM
Rating: 90 (10 reviews)

11-BETA,17-ALPHA,21-TRIHYDROXY-5-ALPHA-PREGNANE-3,20-DIONE

CAS No.:

516-41-6

Catalog Number:

AG00DFDM

Molecular Formula:

Molecular Weight:

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Product Description

Catalog Number:

AG00DFDM

Chemical Name:

11-BETA,17-ALPHA,21-TRIHYDROXY-5-ALPHA-PREGNANE-3,20-DIONE

CAS Number:

516-41-6

MDL Number:

MFCD00056495

IUPAC Name:

(5S,8S,9S,10S,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-3-one

InChI:

InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-16,18,22,24,26H,3-11H2,1-2H3/t12-,14-,15-,16-,18+,19-,20-,21-/m0/s1

InChI Key:

ACSFOIGNUQUIGE-SERXDUEGSA-N

UNII:

364XCM54BS

Properties

Complexity:

632

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

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Exact Mass:

364.225g/mol

Formal Charge:

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Molecular Weight:

364.482g/mol

Monoisotopic Mass:

364.225g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1

Literature

Title	Journal
Potent and selective steroidal inhibitors of 17beta-hydroxysteroid dehydrogenase type 7, an enzyme that catalyzes the reduction of the key hormones estrone and dihydrotestosterone.	Journal of medicinal chemistry 20091210

Properties