UCSF

ZINC04097285

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 28 No

Popular Name: Beclomethasone Beclomethasone

Find On: PubMed — Wikipedia — Google

CAS Number: 4419-39-0

Other Names:

(11beta,16beta)-9-chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione

(8R,9S,10S,11S,13R,14R,16R,17R)-9-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

(8S,9R,10S,11S,13S,14S,16S,17R)-9-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

4419-39-0

4419-39-0; Beclometason (TN); Beclometasone (INN); D07495

4419-39-0; Beclomethasone; C06842

9-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one

9-Chloro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione

9-chloro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione; 9alpha-chloro-16beta-methylprednisolone; Beclomethasone

9-Chloro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione; BMJ 5800; Beclocort; Beclometasona [INN-Spanish]; Beclometasone; Beclometasone [INN]; Beclometasonum [INN-Latin]; Beclomethasone; Becotide; C22H29ClO5; EINECS 224-585-9; LS-174992

9alpha-Chloro-11beta,17alpha,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione

9alpha-Chloro-16beta-methyl-1,4-pregnadiene-11beta,17alpha,21-triol-3,20-dione

9alpha-Chloro-16beta-methylprednisolone

AC1L1DDX

AC1L2GBM

AC1O7G0A

Anceron

B 0385

B0385_SIGMA

BCBcMAP01_000159

Beclocort

Beclometason

Beclometason (TN)

Beclometasona

Beclometasona [INN-Spanish]

beclometasona; beclometasone; beclometasonum

Beclometasondipropionat Mikron

Beclometasone (INN)

Beclometasone [INN]

Beclometasonum

Beclometasonum [INN-Latin]

Becloval

Becodisks

Beconasol

Becotide

BIDD:GT0556

BMJ 5800

C06842

C22H29ClO5

CHEBI:3001

CHEMBL1586

CID11407187

CID11957468

CID20469

CID2308

CID6603734

CPD000466920

D07495

DAP000416

DB00394

EINECS 224-585-9

EU-0100159

HMS2052E17

Inalone

LS-174992

MFCD00135614

MLS000028668

MLS001076089

MLS001333211

MLS001333212

MLS001424231

MLS002153387

MolPort-003-844-701

MolPort-003-940-375

NCGC00015136-01

NCGC00015136-02

NCGC00093647-01

NCGC00162078-01

NCGC00162078-02

NCGC00164402-01

Pregna-1,4-diene-3,20-dione, 9-chloro-11,17,21-trihydroxy-16-methyl-, (11.beta.,16.beta.)-

Pregna-1,4-diene-3,20-dione, 9-chloro-11,17,21-trihydroxy-16-methyl-, (11beta,16beta)-

SAM001246898

SMP1_000039

SMR000058899

SMR000466920

UNII-KGZ1SLC28Z

Vancenase AQ

Viarex

ZINC04097285

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.36 3.78 -14.59 3 5 0 95 408.922 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0000742A1; EP0004975A2; EP0023359A2; EP0029151A2; EP0029924A1; EP0030615A1; EP0039369A1; EP0048280A1; EP0072200A2; EP0072268A1; EP0115965A2; EP0141684A1; EP0158441A2; EP0158441B1; EP0172672A1; EP0173478A1; EP0173478B1; EP0178085A1; EP0178624A2; EP019044 IBM Patent Data
Patent Database Links EP1527772; EP1683514; EP1693053; EP1712220; EP1731140; EP1834635; EP1854487; EP1857101; EP1870090; EP1894559; EP1905451; EP1913942; EP1920773; EP1982709; GB2321455; US2001006962; US2002161004; US2003153544; US2003153545; US2003229092; US2004063677; US2004 ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )