Products for Research Use Only
RegisterLogin

Gestodene-d6

CAT: 1596-AR-G01265-01Size: 10 UnitsDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1596-AR-G01265-01Size:10 Units
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1542211-40-4
Synonyms
(17?) -13-Ethyl-17-hydroxy-18,19-dinorpregna-4,15-dien-20-yn-3-one-d6; Gestodene-d6
Molecular Formula
C21H20D6O2
Molecular Weight
316.47
API Name
Gestodene

Chemical Information

Gestodene-d6
CAS Number1542211-40-4
PubChem CID102227066
IUPAC Name(8R,9S,10R,13S,14S,17R)-2,2,4,6,6,10-hexadeuterio-13-ethyl-17-ethynyl-17-hydroxy-7,8,9,11,12,14-hexahydro-1H-cyclopenta[a]phenanthren-3-one
Molecular FormulaC21H26O2
Molecular Weight316.5
XLogP2.9
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity648
SMILES
[2H]C1=C2[C@](CC(C1=O)([2H])[2H])([C@H]3CC[C@]4([C@H]([C@@H]3CC2([2H])[2H])C=C[C@]4(C#C)O)CC)[2H]
InChI
InChI=1S/C21H26O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,10,12-13,16-19,23H,3,5-9,11H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1/i5D2,6D2,13D,16D
InChIKey
SIGSPDASOTUPFS-PWFLSJGKSA-N
Chemical Structure
2D Structure
2D structure of Gestodene-d6
CAS: 1542211-40-4
CID: 102227066
Formula: C21H26O2
MW: 316.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight316.5
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass316.230940544
Monoisotopic Mass316.230940544
Topological Polar Surface Area37.3 Ų
Heavy Atom Count23
Formal Charge0
Complexity648
Isotope Atom Count6
Defined Atom Stereocenter Count6
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-G01268-01Gestodene
AR-G01282-01Gestodene EP Impurity J (Gestodene Ketal)
AR-G01279-01Gestodene Dimer
AR-G01267-01Gestodene sulfate
AR-G01738-01Methyl Gestodene
AR-G01266-01Gestodene glucuronide
AR-G01269-01Gestodene Impurity C
AR-G01273-01Gestodene EP Impurity A
AR-G01286-01Gestodene Impurity 2
AR-G01283-013-Hydroxydiethynyl Gestodene

Alternative Products

CatalogName
HY-B0110SGestodene-d6
G368252Gestodene-d6 (Major)
MBS386522-01Gestodene

Popular Products