Dicirenone

CAT: 0931-T13881-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0931-T13881-01Size:1 mg

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CAS Number

41020-79-5

Target

Glucocorticoid Receptor, ATPase

Related Pathways

Membrane transporter/Ion channel, Endocrinology/Hormones

Purity

0.991

Bioactivity

Dicirenone (SC26304) inhibits the Mineralocorticoid receptor (MR), aldosterone regulation of the urinary K+:Na+ ratio, and aldosterone binding to renal cytoplasmic and nuclear receptors.

Smiles

C[C@@]12[C@]3(CC[C@]1([C@]4([C@](CC2)([C@]5(C)C(C[C@H]4C(OC(C)C)=O)=CC(=O)CC5)[H])[H])[H])OC(=O)CC3

Molecular Formula

C26H36O5

Molecular Weight

428.56

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Dicirenone

Dicirenone is a steroid lactone.

CAS Number	41020-79-5
PubChem CID	10387872
IUPAC Name	propan-2-yl (7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5'-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-carboxylate
Molecular Formula	C26H36O5
Molecular Weight	428.6
XLogP	2.8
Topological Polar Surface Area	69.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	31
Formal Charge	0
Complexity	858

SMILES

CC(C)OC(=O)[C@@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]5([C@]4(CC3)C)CCC(=O)O5)C

InChI

InChI=1S/C26H36O5/c1-15(2)30-23(29)18-14-16-13-17(27)5-9-24(16,3)19-6-10-25(4)20(22(18)19)7-11-26(25)12-8-21(28)31-26/h13,15,18-20,22H,5-12,14H2,1-4H3/t18-,19+,20+,22-,24+,25+,26-/m1/s1

InChIKey

WUVPAYPBMZMHJO-IMNLCBETSA-N

Chemical Structure

2D Structure

CAS: 41020-79-5

CID: 10387872

Formula: C26H36O5

MW: 428.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	428.6
XLogP3	2.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	428.25627424
Monoisotopic Mass	428.25627424
Topological Polar Surface Area	69.7 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	858
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
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
TRC-D437740-100MG	Dicirenone

Dicirenone

Chemical Information

Alternative Products

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