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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H29ClO5
Molecular Weight 468.969
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 21-CHLORO-16.ALPHA.-METHYL-3,20-DIOXOPREGNA-1,4,9(11)-TRIEN-17-YL FURAN-2-CARBOXYLATE

SMILES

[H][C@@]12C[C@@H](C)[C@](OC(=O)C3=CC=CO3)(C(=O)CCl)[C@@]1(C)CC=C4[C@@]2([H])CCC5=CC(=O)C=C[C@]45C

InChI

InChIKey=GSJLBVBYMSNTPZ-XACSLSAESA-N
InChI=1S/C27H29ClO5/c1-16-13-21-19-7-6-17-14-18(29)8-10-25(17,2)20(19)9-11-26(21,3)27(16,23(30)15-28)33-24(31)22-5-4-12-32-22/h4-5,8-10,12,14,16,19,21H,6-7,11,13,15H2,1-3H3/t16-,19-,21+,25+,26+,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H29ClO5
Molecular Weight 468.969
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:59:37 UTC 2023
Edited
by admin
on Sat Dec 16 18:59:37 UTC 2023
Record UNII
M2A68F897F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
21-CHLORO-16.ALPHA.-METHYL-3,20-DIOXOPREGNA-1,4,9(11)-TRIEN-17-YL FURAN-2-CARBOXYLATE
Systematic Name English
MOMETASONE FUROATE IMPURITY A [EP IMPURITY]
Common Name English
(16.ALPHA.)-21-CHLORO-17-((2-FURANYLCARBONYL)OXY)-16-METHYLPREGNA-1,4,9(11)-TRIENE-3,20-DIONE
Systematic Name English
PREGNA-1,4,9(11)-TRIENE-3,20-DIONE, 21-CHLORO-17-((2-FURANYLCARBONYL)OXY)-16-METHYL-, (16.ALPHA.)-
Systematic Name English
Code System Code Type Description
CAS
83880-65-3
Created by admin on Sat Dec 16 18:59:37 UTC 2023 , Edited by admin on Sat Dec 16 18:59:37 UTC 2023
PRIMARY
FDA UNII
M2A68F897F
Created by admin on Sat Dec 16 18:59:37 UTC 2023 , Edited by admin on Sat Dec 16 18:59:37 UTC 2023
PRIMARY
PUBCHEM
13888750
Created by admin on Sat Dec 16 18:59:37 UTC 2023 , Edited by admin on Sat Dec 16 18:59:37 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP