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Details

Stereochemistry EPIMERIC
Molecular Formula C25H34O7
Molecular Weight 446.5333
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6.ALPHA.-HYDROXYBUDESONIDE

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])C[C@H](O)C5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]1(OC(CCC)O2)C(=O)CO

InChI

InChIKey=JBVVDXJXIDYDMF-HLQSUVNBSA-N
InChI=1S/C25H34O7/c1-4-5-21-31-20-10-15-14-9-17(28)16-8-13(27)6-7-23(16,2)22(14)18(29)11-24(15,3)25(20,32-21)19(30)12-26/h6-8,14-15,17-18,20-22,26,28-29H,4-5,9-12H2,1-3H3/t14-,15-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
6.ALPHA.-HYDROXYBUDESONIDE
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 16,17-(BUTYLIDENEBIS(OXY))-6,11,21-TRIHYDROXY-, (6.ALPHA.,11.BETA.,16.ALPHA.)-
Systematic Name English
Code System Code Type Description
FDA UNII
FS0TQI5AVI
Created by admin on Sat Dec 16 08:45:07 GMT 2023 , Edited by admin on Sat Dec 16 08:45:07 GMT 2023
PRIMARY
CAS
577777-51-6
Created by admin on Sat Dec 16 08:45:07 GMT 2023 , Edited by admin on Sat Dec 16 08:45:07 GMT 2023
PRIMARY
RS_ITEM_NUM
1A01390
Created by admin on Sat Dec 16 08:45:07 GMT 2023 , Edited by admin on Sat Dec 16 08:45:07 GMT 2023
PRIMARY
PUBCHEM
45039413
Created by admin on Sat Dec 16 08:45:07 GMT 2023 , Edited by admin on Sat Dec 16 08:45:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID60662007
Created by admin on Sat Dec 16 08:45:07 GMT 2023 , Edited by admin on Sat Dec 16 08:45:07 GMT 2023
PRIMARY