[NO NAME]
  Mrv0541 04211220072D          
Created with ChemWriter - http://chemwriter.com
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M  END
> <DATABASE_ID>
DB00394

> <DATABASE_NAME>
drugbank

> <SMILES>
[H][C@@]12C[C@H](C)[C@](OC(=O)CC)(C(=O)COC(=O)CC)[C@@]1(C)C[C@H](O)[C@@]1(Cl)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C

> <INCHI_IDENTIFIER>
InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1

> <INCHI_KEY>
KUVIULQEHSCUHY-XYWKZLDCSA-N

> <FORMULA>
C28H37ClO7

> <MOLECULAR_WEIGHT>
521.042

> <EXACT_MASS>
520.222781245

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
73

> <JCHEM_AVERAGE_NEUTRAL_MICROSPECIES_CHARGE>
-1.4369542149718302e-07

> <JCHEM_AVERAGE_POLARIZABILITY>
54.4572001685742

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
2-[(1R,2S,3aS,3bS,9aS,9bR,10S,11aS)-9b-chloro-10-hydroxy-2,9a,11a-trimethyl-7-oxo-1-(propanoyloxy)-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl propanoate

> <ALOGPS_LOGP>
3.69

> <JCHEM_LOGP>
4.428392276333331

> <ALOGPS_LOGS>
-5.40

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NEUTRAL_CHARGE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
15.57687155060059

> <JCHEM_PKA_STRONGEST_ACIDIC>
13.850504148188556

> <JCHEM_PKA_STRONGEST_BASIC>
-3.297902806491472

> <JCHEM_POLAR_SURFACE_AREA>
106.97

> <JCHEM_REFRACTIVITY>
134.7928

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.08e-03 g/l

> <JCHEM_TRADITIONAL_IUPAC>
tetrahydrofolic acid

> <JCHEM_VEBER_RULE>
0

> <DRUGBANK_ID>
DB00394

> <SECONDARY_ACCESSION_NUMBERS>
APRD00564; DB11897

> <DRUG_GROUPS>
approved; investigational

> <GENERIC_NAME>
Beclomethasone dipropionate

> <SYNONYMS>
(11β,16β)-9-chloro-11-hydroxy-16-methyl-17,21-bis(1-oxopropoxy)pregna-1,4-diene-3,20-dione; 9-chloro-11β-hydroxy-16β-methylpregna-1,4-diene-3,20-dione 17,21-dipropionate; 9-chloro-16β-methyl-11β,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-dipropionate; beclometasone 17,21-dipropionate; Beclometasone dipropionate; Beclometasone dipropionate anhydrous; Beclometasone dipropionato; Beclomethasone dipropionate

> <PRODUCTS>
Alti-beclomethasone Dipropionate Inhaler 50mcg/md; Apo-beclomethasone Nasal Spray; Beclodisk - Pwr Inh 100mcg/blister; Beclodisk - Pwr Inh 200mcg/blister; Beclodisk Pwr 100mcg/blister; Beclodisk Pwr 200mcg/blister; Becloforte 250mcg/aem; Becloforte Inhaler - Aem Inh 250mcg/aem; Beclomethasone Aqueous Nasal Spray 50mcg/metered Dose; Beclomethasone Dipropionate Nas-spr 50mcg/aem; Beclomethasone Dipropionate Nasal Inhaler; Beclomethasone Dipropionate Oral Inhaler; Beclomethasone Nasal Spray; Beclovent - Aem 50mcg/aem; Beclovent Aem 50mcg/aem; Beclovent Rotacaps - Inh 100mcg/capsule; Beclovent Rotacaps - Inh 200mcg/cap; Beclovent Rotacaps 100mcg; Beclovent Rotacaps 200mcg; Beconase AQ; Beconase AQ Nasal Aem 50mcg/aem; Beconase Nasal Aem 50mcg/aem; Mylan-beclo AQ; Propaderm; Propaderm Cream 0.025%; Propaderm Lot 0.025%; Propaderm Lotion 0.025%; Qnasl; Qvar; Qvar Redihaler; Ratio-beclomethasone AQ; Riarify; Rivanase AQ.nasal Spray 50mcg/metered Dose; Trimbow; Trydonis; Vancenase Aer 50mcg; Vanceril Aem 50mcg

> <INTERNATIONAL_BRANDS>
Aerobec; Aldecin; Anceron; Andion; Beclacin; Becloforte; Beclomet; Beclorhinol; Becloval; Beclovent; Becodisks; Beconase; Beconasol; Becotide; Clenil-A; Entyderma; Inalone; Korbutone; orBec; Rino-Clenil; Rivanase; Sanasthmax; Sanasthmyl; Vancenase; Vanceril

> <SALTS>
Beclomethasone dipropionate monohydrate

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