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

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H26N4O4
Molecular Weight 446.4983
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OTAMIXABAN

SMILES

COC(=O)[C@H](CC1=CC=CC(=C1)C(N)=N)[C@@H](C)NC(=O)C2=CC=C(C=C2)C3=CC=[N+]([O-])C=C3

InChI

InChIKey=PFGVNLZDWRZPJW-OPAMFIHVSA-N
InChI=1S/C25H26N4O4/c1-16(22(25(31)33-2)15-17-4-3-5-21(14-17)23(26)27)28-24(30)20-8-6-18(7-9-20)19-10-12-29(32)13-11-19/h3-14,16,22H,15H2,1-2H3,(H3,26,27)(H,28,30)/t16-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H26N4O4
Molecular Weight 446.4983
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:11:04 UTC 2023
Edited
by admin
on Fri Dec 15 16:11:04 UTC 2023
Record UNII
S173RED00L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OTAMIXABAN
INN   MI   WHO-DD  
INN  
Official Name English
otamixaban [INN]
Common Name English
METHYL (2R,3R)-2-(3-CARBAMIMIDOYLBENZYL)-3-((4-(1-OXIDOPYRIDIN-4-YL)BENZOYL)AMINO)BUTANOATE
Systematic Name English
FXV673
Code English
OTAMIXABAN [MI]
Common Name English
FXV-673
Code English
RPR130673
Code English
RPR-130673
Code English
XRP0673
Code English
Otamixaban [WHO-DD]
Common Name English
XRP-0673
Code English
Classification Tree Code System Code
NCI_THESAURUS C263
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID40172917
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
FDA UNII
S173RED00L
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
MERCK INDEX
m8266
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY Merck Index
PUBCHEM
5496659
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
ChEMBL
CHEMBL46618
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
NCI_THESAURUS
C90704
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
WIKIPEDIA
OTAMIXABAN
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
DRUG BANK
DB06635
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
SMS_ID
300000034257
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
INN
8096
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
CAS
193153-04-7
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
MESH
C435830
Created by admin on Fri Dec 15 16:11:04 UTC 2023 , Edited by admin on Fri Dec 15 16:11:04 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY