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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H31BrO6
Molecular Weight 495.403
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMODESONIDE

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)C=C[C@]5(C)[C@@]4(Br)[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)CO

InChI

InChIKey=HEPIBRLGCSXTQU-JNQJZLCISA-N
InChI=1S/C24H31BrO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H31BrO6
Molecular Weight 495.403
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 16:37:06 UTC 2023
Edited
by admin
on Sat Dec 16 16:37:06 UTC 2023
Record UNII
S3VK6N29U8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMODESONIDE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9-BROMO-11,21-DIHYDROXY-16,17-((1-METHYLETHYLIDENE)BIS(OXY))-, (11.BETA.,16.ALPHA.)-
Systematic Name English
BROMODESONIDE [USP IMPURITY]
Common Name English
9.ALPHA.-BROMODESONIDE
Common Name English
9-BROMO-11.BETA.,16.ALPHA.,17,21-TETRAHYDROXYPREGNA-1,4-DIENE-3,20-DIONE, 16,17-ACETONIDE
Systematic Name English
9.ALPHA.-BROMO-11.BETA.,21-DIHYDROXY-16.ALPHA.,17-((1-METHYLETHYLIDENE)BIS(OXY))PREGNA-1,4-DIENE-3,20-DIONE
Systematic Name English
Code System Code Type Description
FDA UNII
S3VK6N29U8
Created by admin on Sat Dec 16 16:37:06 UTC 2023 , Edited by admin on Sat Dec 16 16:37:06 UTC 2023
PRIMARY
CAS
39672-77-0
Created by admin on Sat Dec 16 16:37:06 UTC 2023 , Edited by admin on Sat Dec 16 16:37:06 UTC 2023
PRIMARY
PUBCHEM
101638606
Created by admin on Sat Dec 16 16:37:06 UTC 2023 , Edited by admin on Sat Dec 16 16:37:06 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP