Cloprednol

CAT: 0926-FC20516-01Size: 2 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-FC20516-01Size:2 mg

Selected

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

Quick Request Actions

CAS Number

5251-34-3

Synonyms

(11b) -6-Chloro-11,17,21-trihydroxypregna-1,4,6-triene-3,20-dione;6-Chloro-11b,17,21-trihydroxy-pregna-1,4,6-triene-3,20-dione; Cl

Smiles

C[C@]12C[C@@H] ([C@H]3[C@H] ([C@@H]1CC[C@@]2 (C (=O) CO) O) C=C (C4=CC (=O) C=C[C@]34C) Cl) O

Molecular Formula

C21H25ClO5

Molecular Weight

392.87 g/mol

Controlled

Chemical Information

Cloprednol

Cloprednol is a 21-hydroxy steroid.

CAS Number	5251-34-3
PubChem CID	5284535
IUPAC Name	(8S,9S,10R,11S,13S,14S,17R)-6-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one
Molecular Formula	C21H25ClO5
Molecular Weight	392.9
XLogP	1.9
Topological Polar Surface Area	94.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	27
Formal Charge	0
Complexity	813

SMILES

C[C@]12C[C@@H]([C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)C=C(C4=CC(=O)C=C[C@]34C)Cl)O

InChI

InChI=1S/C21H25ClO5/c1-19-5-3-11(24)7-14(19)15(22)8-12-13-4-6-21(27,17(26)10-23)20(13,2)9-16(25)18(12)19/h3,5,7-8,12-13,16,18,23,25,27H,4,6,9-10H2,1-2H3/t12-,13-,16-,18+,19-,20-,21-/m0/s1

InChIKey

YTJIBEDMAQUYSZ-FDNPDPBUSA-N

Chemical Structure

2D Structure

CAS: 5251-34-3

CID: 5284535

Formula: C21H25ClO5

MW: 392.9

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	392.9
XLogP3	1.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	392.1390516
Monoisotopic Mass	392.1390516
Topological Polar Surface Area	94.8 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	813
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
RM-C123500-01	Cloprednol
HY-119296R	Cloprednol (Standard)
sc-499863	21-Dehydro Cloprednol

Cloprednol

Chemical Information

Alternative Products

Popular Products