U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry EPIMERIC
Molecular Formula C22H28O4
Molecular Weight 356.4553
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 11.BETA.,20-DIHYDROXY-6-METHYLPREGNA-1,4,17(20)-TRIENE-3,21-DIONE

SMILES

[H][C@@]12CCC(C(=O)C=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=SAEWKRGIAWAQEZ-QOVUUNBYSA-N
InChI=1S/C22H28O4/c1-12-8-14-15-4-5-16(19(26)11-23)22(15,3)10-18(25)20(14)21(2)7-6-13(24)9-17(12)21/h6-7,9,11-12,14-16,18,20,25H,4-5,8,10H2,1-3H3/t12-,14-,15-,16?,18-,20+,21-,22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
11.BETA.,20-DIHYDROXY-6-METHYLPREGNA-1,4,17(20)-TRIENE-3,21-DIONE
Systematic Name English
METHYLPREDNISOLONE IMPURITY D [EP IMPURITY]
Common Name English
METHYLPREDNISOLONE RELATED COMPOUND D [USP IMPURITY]
Common Name English
Code System Code Type Description
CAS
1338549-02-2
Created by admin on Sat Dec 16 18:20:18 GMT 2023 , Edited by admin on Sat Dec 16 18:20:18 GMT 2023
PRIMARY
PUBCHEM
131667993
Created by admin on Sat Dec 16 18:20:18 GMT 2023 , Edited by admin on Sat Dec 16 18:20:18 GMT 2023
PRIMARY
FDA UNII
7D6KJ7YT6X
Created by admin on Sat Dec 16 18:20:18 GMT 2023 , Edited by admin on Sat Dec 16 18:20:18 GMT 2023
PRIMARY