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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H34O6
Molecular Weight 430.5339
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUDESONIDE (11.BETA.,16.ALPHA.(S))

SMILES

[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]1(O[C@@H](CCC)O2)C(=O)CO

InChI

InChIKey=VOVIALXJUBGFJZ-AMTWPJRWSA-N
InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3/t16-,17-,18-,20+,21-,22+,23-,24-,25+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BUDESONIDE (11.BETA.,16.ALPHA.(S))
Common Name English
PREGNA-1,4-DIENE-3,20-DIONE, 16,17-BUTYLIDENEBIS(OXY)-11,21-DIHYDROXY-, (11.BETA.,16.ALPHA.(S))
Common Name English
BUDESONIDE (11BETA,16ALPHA(S))
Common Name English
BUDESONIDE, (S)-
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C521
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
Code System Code Type Description
FDA UNII
168L5HT37P
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID20860628
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
SMS_ID
100000144023
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
ECHA (EC/EINECS)
257-160-1
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
NCI_THESAURUS
C80808
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
EVMPD
SUB120771
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
CAS
51372-28-2
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY
RXCUI
1367172
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY RxNorm
PUBCHEM
63006
Created by admin on Fri Dec 15 15:54:35 GMT 2023 , Edited by admin on Fri Dec 15 15:54:35 GMT 2023
PRIMARY