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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H32O6
Molecular Weight 428.518
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BETAMETHASONE 9,11-EPOXIDE 21-PROPIONATE

SMILES

[H][C@@]12C[C@H](C)[C@](O)(C(=O)COC(=O)CC)[C@@]1(C)C[C@@H]3O[C@]34[C@@]2([H])CCC5=CC(=O)C=C[C@]45C

InChI

InChIKey=VHNLZHWRYPLCSE-QYIVYLGBSA-N
InChI=1S/C25H32O6/c1-5-21(28)30-13-19(27)24(29)14(2)10-18-17-7-6-15-11-16(26)8-9-22(15,3)25(17)20(31-25)12-23(18,24)4/h8-9,11,14,17-18,20,29H,5-7,10,12-13H2,1-4H3/t14-,17-,18-,20-,22-,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H32O6
Molecular Weight 428.518
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 10:46:24 UTC 2023
Edited
by admin
on Sat Dec 16 10:46:24 UTC 2023
Record UNII
V40RI2B7TL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BETAMETHASONE 9,11-EPOXIDE 21-PROPIONATE
Common Name English
9,11.BETA.-EPOXY-17-HYDROXY-16.BETA.-METHYL-3,20-DIOXO-9.BETA.-PREGNA-1,4-DIEN-21-YL PROPANOATE
Systematic Name English
PREGNA-1,4-DIENE-3,20-DIONE, 9,11-EPOXY-17-HYDROXY-16-METHYL-21-(1-OXOPROPOXY)-, (9.BETA.,11.BETA.,16.BETA.)-
Systematic Name English
BECLOMETHASONE DIPROPIONATE IMPURITY V [EP IMPURITY]
Common Name English
Code System Code Type Description
PUBCHEM
71313954
Created by admin on Sat Dec 16 10:46:24 UTC 2023 , Edited by admin on Sat Dec 16 10:46:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID40747144
Created by admin on Sat Dec 16 10:46:24 UTC 2023 , Edited by admin on Sat Dec 16 10:46:24 UTC 2023
PRIMARY
FDA UNII
V40RI2B7TL
Created by admin on Sat Dec 16 10:46:24 UTC 2023 , Edited by admin on Sat Dec 16 10:46:24 UTC 2023
PRIMARY
CAS
205105-83-5
Created by admin on Sat Dec 16 10:46:24 UTC 2023 , Edited by admin on Sat Dec 16 10:46:24 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP