Amelometasone

CAT: 0931-T29962-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T29962-02Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

123013-22-9

Target

Others

Related Pathways

Others

Bioactivity

Amelometasone is a biochemical.

Smiles

C(COC)(=O)[C@]1(OC(CC)=O)[C@]2(C)[C@@](C[C@@H]1C)([C@]3([C@](F)([C@@H](O)C2)[C@]4(C)C(CC3)=CC(=O)C=C4)[H])[H]

Molecular Formula

C26H35FO6

Molecular Weight

462.55

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Amelometasone

Amelometasone is a corticosteroid hormone.

CAS Number	123013-22-9
PubChem CID	443880
IUPAC Name	[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-methoxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
Molecular Formula	C26H35FO6
Molecular Weight	462.5
XLogP	3.1
Topological Polar Surface Area	89.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Heavy Atom Count	33
Formal Charge	0
Complexity	941

SMILES

CCC(=O)O[C@@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)C(=O)COC

InChI

InChI=1S/C26H35FO6/c1-6-22(31)33-26(21(30)14-32-5)15(2)11-19-18-8-7-16-12-17(28)9-10-23(16,3)25(18,27)20(29)13-24(19,26)4/h9-10,12,15,18-20,29H,6-8,11,13-14H2,1-5H3/t15-,18-,19-,20-,23-,24-,25-,26-/m0/s1

InChIKey

ZMYGOSBRLPSJNB-SOMXGXJRSA-N

Chemical Structure

2D Structure

CAS: 123013-22-9

CID: 443880

Formula: C26H35FO6

MW: 462.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	462.5
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	6
Exact Mass	462.24176699
Monoisotopic Mass	462.24176699
Topological Polar Surface Area	89.9 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	941
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
MBS5779590	Amelometasone

Amelometasone

Chemical Information

Alternative Products

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