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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H37FO6
Molecular Weight 476.5775
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETAMETHASONE 21-VALERATE

SMILES

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

InChI

InChIKey=FEROCCAEIIKMJT-SUYDQAKGSA-N
InChI=1S/C27H37FO6/c1-5-6-7-23(32)34-15-22(31)27(33)16(2)12-20-19-9-8-17-13-18(29)10-11-24(17,3)26(19,28)21(30)14-25(20,27)4/h10-11,13,16,19-21,30,33H,5-9,12,14-15H2,1-4H3/t16-,19-,20-,21-,24-,25-,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H37FO6
Molecular Weight 476.5775
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 09:51:50 UTC 2023
Edited
by admin
on Sat Dec 16 09:51:50 UTC 2023
Record UNII
BW52JZ3627
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETAMETHASONE 21-VALERATE
Common Name English
BETAMETHASONE VALERATE RELATED COMPOUND A
USP-RS  
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11,17-DIHYDROXY-16-METHYL-21-((1-OXOPENTYL)OXY)-, (11.BETA.,16.BETA.)-
Systematic Name English
BETAMETHASONE VALERATE IMPURITY E [EP IMPURITY]
Common Name English
BETAMETHASONE VALERATE RELATED COMPOUND A [USP-RS]
Common Name English
BETAMETHASONE 21-PENTANOATE
Common Name English
Code System Code Type Description
FDA UNII
BW52JZ3627
Created by admin on Sat Dec 16 09:51:50 UTC 2023 , Edited by admin on Sat Dec 16 09:51:50 UTC 2023
PRIMARY
EPA CompTox
DTXSID30945051
Created by admin on Sat Dec 16 09:51:50 UTC 2023 , Edited by admin on Sat Dec 16 09:51:50 UTC 2023
PRIMARY
CAS
2240-28-0
Created by admin on Sat Dec 16 09:51:50 UTC 2023 , Edited by admin on Sat Dec 16 09:51:50 UTC 2023
PRIMARY
PUBCHEM
92922
Created by admin on Sat Dec 16 09:51:50 UTC 2023 , Edited by admin on Sat Dec 16 09:51:50 UTC 2023
PRIMARY
RS_ITEM_NUM
1069018
Created by admin on Sat Dec 16 09:51:50 UTC 2023 , Edited by admin on Sat Dec 16 09:51:50 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
ACTIVE MOIETY