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Details

Stereochemistry ACHIRAL
Molecular Formula C20H26O3
Molecular Weight 314.4186
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 11.BETA.-HYDROXY-6.ALPHA.-METHYLANDROSTA-1,4-DIENE-3,17-DIONE

SMILES

[H][C@@]12CCC(=O)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])C[C@H](C)C4=CC(=O)C=C[C@]34C

InChI

InChIKey=TVJLVPVXJZGLPJ-CCASCXMYSA-N
InChI=1S/C20H26O3/c1-11-8-13-14-4-5-17(23)20(14,3)10-16(22)18(13)19(2)7-6-12(21)9-15(11)19/h6-7,9,11,13-14,16,18,22H,4-5,8,10H2,1-3H3/t11-,13-,14-,16-,18+,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H26O3
Molecular Weight 314.4186
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:32:57 UTC 2023
Edited
by admin
on Sat Dec 16 10:32:57 UTC 2023
Record UNII
UP4NO9901H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
11.BETA.-HYDROXY-6.ALPHA.-METHYLANDROSTA-1,4-DIENE-3,17-DIONE
Systematic Name English
METHYLPREDNISOLONE RELATED COMPOUND C [USP IMPURITY]
Common Name English
METHYLPREDNISOLONE RELATED COMPOUND C [USP-RS]
Common Name English
METHYLPREDNISOLONE IMPURITY C [EP IMPURITY]
Common Name English
ANDROSTA-1,4-DIENE-3,17-DIONE, 11-HYDROXY-6-METHYL-, (6.ALPHA.,11.BETA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
UP4NO9901H
Created by admin on Sat Dec 16 10:32:57 UTC 2023 , Edited by admin on Sat Dec 16 10:32:57 UTC 2023
PRIMARY
RS_ITEM_NUM
1435036
Created by admin on Sat Dec 16 10:32:57 UTC 2023 , Edited by admin on Sat Dec 16 10:32:57 UTC 2023
PRIMARY
CAS
61919-52-6
Created by admin on Sat Dec 16 10:32:57 UTC 2023 , Edited by admin on Sat Dec 16 10:32:57 UTC 2023
PRIMARY
PUBCHEM
15086059
Created by admin on Sat Dec 16 10:32:57 UTC 2023 , Edited by admin on Sat Dec 16 10:32:57 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP