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Galeterone Impurity 1

CAT: 1299-RM-G123801-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-G123801-01Size:10 mg
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CAS Number
851983-85-2
Synonyms
(3S,8R,9S,10R,13S,14S) -17- (1H-benzo[d]imidazol-1-yl) -10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Molecular Formula
C26H32N2O
Molecular Weight
388.56
Target Alternative Name
Galeterone
Product Name Synonym
(3S,8R,9S,10R,13S,14S) -17- (1H-benzo[d]imidazol-1-yl) -10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Chemical Information

Galeterone

Galeterone is a 3-hydroxy steroid. It has a role as an androgen.

CAS Number851983-85-2
PubChem CID11188409
IUPAC Name(3S,8R,9S,10R,13S,14S)-17-(benzimidazol-1-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol
Molecular FormulaC26H32N2O
Molecular Weight388.5
XLogP5.2
Topological Polar Surface Area38.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count29
Formal Charge0
Complexity743
SMILES
C[C@]12CC[C@@H](CC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4N5C=NC6=CC=CC=C65)C)O
InChI
InChI=1S/C26H32N2O/c1-25-13-11-18(29)15-17(25)7-8-19-20-9-10-24(26(20,2)14-12-21(19)25)28-16-27-22-5-3-4-6-23(22)28/h3-7,10,16,18-21,29H,8-9,11-15H2,1-2H3/t18-,19-,20-,21-,25-,26-/m0/s1
InChIKey
PAFKTGFSEFKSQG-PAASFTFBSA-N
Chemical Structure
2D Structure
2D structure of Galeterone
CAS: 851983-85-2
CID: 11188409
Formula: C26H32N2O
MW: 388.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight388.5
XLogP35.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass388.251463648
Monoisotopic Mass388.251463648
Topological Polar Surface Area38.1 Ų
Heavy Atom Count29
Formal Charge0
Complexity743
Isotope Atom Count0
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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