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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H33ClO8
Molecular Weight 508.988
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BECLOMETHASONE 21-HEMISUCCINATE

SMILES

[H][C@@]12C[C@H](C)[C@](O)(C(=O)COC(=O)CCC(O)=O)[C@@]1(C)C[C@H](O)[C@@]3(Cl)[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=PEPQYWLBRHFUAQ-UYXSPTSISA-N
InChI=1S/C26H33ClO8/c1-14-10-18-17-5-4-15-11-16(28)8-9-23(15,2)25(17,27)19(29)12-24(18,3)26(14,34)20(30)13-35-22(33)7-6-21(31)32/h8-9,11,14,17-19,29,34H,4-7,10,12-13H2,1-3H3,(H,31,32)/t14-,17-,18-,19-,23-,24-,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H33ClO8
Molecular Weight 508.988
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:25:41 GMT 2023
Edited
by admin
on Sat Dec 16 10:25:41 GMT 2023
Record UNII
TS50A3ZPRI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BECLOMETHASONE 21-HEMISUCCINATE
Common Name English
(11.BETA.,16.BETA.)-21-(3-CARBOXY-1-OXOPROPOXY)-9-CHLORO-11,17-DIHYDROXY-16-METHYLPREGNA-1,4-DIENE-3,20-DIONE
Systematic Name English
PREGNA-1,4-DIENE-3,20-DIONE, 21-(3-CARBOXY-1-OXOPROPOXY)-9-CHLORO-11,17-DIHYDROXY-16-METHYL-, (11.BETA.,16.BETA.)-
Systematic Name English
Code System Code Type Description
PUBCHEM
117587571
Created by admin on Sat Dec 16 10:25:41 GMT 2023 , Edited by admin on Sat Dec 16 10:25:41 GMT 2023
PRIMARY
CAS
75899-57-9
Created by admin on Sat Dec 16 10:25:41 GMT 2023 , Edited by admin on Sat Dec 16 10:25:41 GMT 2023
PRIMARY
FDA UNII
TS50A3ZPRI
Created by admin on Sat Dec 16 10:25:41 GMT 2023 , Edited by admin on Sat Dec 16 10:25:41 GMT 2023
PRIMARY