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

Details

Stereochemistry ACHIRAL
Molecular Formula C33H52N8O8S2
Molecular Weight 752.945
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BERDOXAM

SMILES

CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=S)NC1=CC=C(C=C1)N=C=S

InChI

InChIKey=HBAYEVATSBINBX-UHFFFAOYSA-N
InChI=1S/C33H52N8O8S2/c1-26(42)39(47)22-8-2-5-19-34-29(43)15-17-31(45)40(48)23-9-3-6-20-35-30(44)16-18-32(46)41(49)24-10-4-7-21-36-33(51)38-28-13-11-27(12-14-28)37-25-50/h11-14,47-49H,2-10,15-24H2,1H3,(H,34,43)(H,35,44)(H2,36,38,51)

HIDE SMILES / InChI

Approval Year

Name Type Language
BERDOXAM
USAN  
Official Name English
BERDOXAM [USAN]
Common Name English
N4-(5-((4-((5-(ACETYLHYDROXYAMINO)PENTYL)AMINO)-1,4-DIOXOBUTYL)HYDROXYAMINO)PENTYL)-N1-HYDROXY-N1-(5-((((4-ISOTHIOCYANATOPHENYL)AMINO)THIOXOMETHYL)AMINO)PENTYL)BUTANEDIAMIDE
Systematic Name English
P-ISOTHIOCYANATOBENZYL-DESFERRIOXAMINE
Common Name English
BUTANEDIAMIDE, N4-(5-((4-((5-(ACETYLHYDROXYAMINO)PENTYL)AMINO)-1,4-DIOXOBUTYL)HYDROXYAMINO)PENTYL)-N1-HYDROXY-N1-(5-((((4-ISOTHIOCYANATOPHENYL)AMINO)THIOXOMETHYL)AMINO)PENTYL)-
Common Name English
N1-HYDROXY-N1-(5-(4-(HYDROXY(5-(3-(4-ISOTHIOCYANATOPHENYL)THIOUREIDO)PENTYL)AMINO)-4-OXOBUTANAMIDO)PENTYL)-N4-(5-(N-HYDROXYACETAMIDO)PENTYL)SUCCINAMIDE
Systematic Name English
P-SCN-BN-DEFEROXAMINE
Common Name English
Code System Code Type Description
FDA UNII
TMK6ND3QJH
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY
SMS_ID
300000044077
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY
USAN
JK-119
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY
CAS
1222468-90-7
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY
PUBCHEM
24983484
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY
NCI_THESAURUS
C188628
Created by admin on Sat Dec 16 13:39:57 GMT 2023 , Edited by admin on Sat Dec 16 13:39:57 GMT 2023
PRIMARY