Bioactive Compound Details

BioIDbio1900
NameBECLOMETHASONE DIPROPIONATE
ChEMBL IDCHEMBL1200500
Molecular FormulaC28H37ClO7
Molecular Weight521.05
Molecular Weight (Monoisotopic)520.2228
TypeSmall molecule
Max PhasePhase 4
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAEROBEC 100|AEROBEC 50|AEROBEC FTE 250|ASMABEC CLICKHALER|ASMABEC SPACEHALER|BECLAZONE 100|BECLAZONE 100 E-BREATHE|BECLAZONE 200|BECLAZONE 250|BECLAZONE 250 E-BREATHE|BECLAZONE 50|BECLAZONE 50 E-BREATHE|BECLOAQUA 50|BECLOFORTE|BECLOFORTE E-BREATHE|BECLOFORTE INTEGRA|BECLOFORTE-VM|BECLOMET DIPROP|BECLOMET HAYFEVER|BECLOMETASONA|BECLOMETASONE|BECLOMETASONE DIPROPIONATE|BECLOMETHASONE|BECLOMETHASONE DIPROPIONATE|BECLOMETHASONE DIPROPIONATE MONOHYDRATE|BECLOMIST|BECLOTAIDE|BECLOVENT|BECODISKS|BECONASE|BECONASE AQ|BECOTIDE|BECOTIDE 100|BECOTIDE 100 E-BREATHE|BECOTIDE 200|BECOTIDE 50|BECOTIDE 50 E-BREATHE|CLENIL MODULITE|CLIPPER|FILAIR 100|FILAIR 50|FILAIR FTE|FOSTAIR|FOSTAIR NEXTHALER|NASOBEC AQ|NASOBEC HAYFEVER|NSC-755901|PROPADERM|PROPADERM FTE|PROPADERM-A|PROPADERM-C|PULVINAL BECLOMET|QNASL|QVAR 100|QVAR 100 E-BREATHE|QVAR 40|QVAR 50|QVAR 50 E-BREATHE|QVAR 80|QVAR REDIHALER|RINO CLENIL|SCH 18020W|SCH 8020W|SCH-18020W|SGX-201|SGX-202|SGX-203|VANCENASE|VANCENASE AQ|VANCENASE POCKETHALER|VANCERIL|VANCERIL DOUBLE STRENGTH|VENTIDE|VIVABEC|ZONIVENT AQUANASAL
SmilesCCC(=O)OCC(=O)[C@@]1(OC(=O)CC)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@@]21C
InchiInChI=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 KeyKUVIULQEHSCUHY-XYWKZLDCSA-N
Molecular SpeciesNEUTRAL
Targets132.0
Bioactivities1157.0
Np Likeness Score1.71
Records Key['1a', '3', '1a (beclomethasone propionate, BDP)', 'beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', '3 (beclomethasone 17,21-dipropionate)', 'Beclomethasone Dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'Beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'Beclomethasone Dipropionate', 'SID144206719', 'BDP', 'Beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'SID56463541', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'SAM002699895', 'EUB0000931a', 'EUB0000931a', 'EUB0000931a', 'EUB0000931a', 'BA1000731', 'beclometasone dipropionate']
Records Name['Propionic acid 9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-(2-propionyloxy-acetyl)-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl ester', 'Propionic acid 2-(9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propionyloxy-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl ester', 'Propionic acid 2-(9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propionyloxy-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl ester (beclomethasone propionate, BDP)', 'beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'Propionic acid 9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-(2-propionyloxy-acetyl)-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl ester', 'Beclomethasone Dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'Beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'Beclomethasone Dipropionate', 'SID144206719', 'Beclomethasone dipropionate', 'Beclomethasone dipropionate', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'SID56463541', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'BECLOMETHASONE DIPROPIONATE', 'C0164836', 'Beclomethasone dipropionate', 'Beclomethasone dipropionate', 'Beclomethasone dipropionate', 'Beclomethasone dipropionate', None, 'beclometasone dipropionate']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure