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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H20BrNO2
Molecular Weight 338.24
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RTI-51

SMILES

COC(=O)[C@@H]1[C@@H]2CC[C@H](C[C@@H]1C3=CC=C(Br)C=C3)N2C

InChI

InChIKey=HNVGNUVAMRLMSG-KBXIAJHMSA-N
InChI=1S/C16H20BrNO2/c1-18-12-7-8-14(18)15(16(19)20-2)13(9-12)10-3-5-11(17)6-4-10/h3-6,12-15H,7-9H2,1-2H3/t12-,13-,14+,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H20BrNO2
Molecular Weight 338.24
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:19:16 GMT 2023
Edited
by admin
on Sat Dec 16 17:19:16 GMT 2023
Record UNII
C3MV2GV7R7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RTI-51
Code English
Methyl (1R,2S,3S,5S)-3-(4-bromophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Systematic Name English
RTI4229-51
Code English
RTI-4229-51
Code English
8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-bromophenyl)-8-methyl-, methyl ester, (1R,2S,3S,5S)-
Systematic Name English
Code System Code Type Description
CAS
135367-08-7
Created by admin on Sat Dec 16 17:19:16 GMT 2023 , Edited by admin on Sat Dec 16 17:19:16 GMT 2023
PRIMARY
FDA UNII
C3MV2GV7R7
Created by admin on Sat Dec 16 17:19:16 GMT 2023 , Edited by admin on Sat Dec 16 17:19:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID40720932
Created by admin on Sat Dec 16 17:19:16 GMT 2023 , Edited by admin on Sat Dec 16 17:19:16 GMT 2023
PRIMARY
PUBCHEM
9819204
Created by admin on Sat Dec 16 17:19:16 GMT 2023 , Edited by admin on Sat Dec 16 17:19:16 GMT 2023
PRIMARY
WIKIPEDIA
RTI-51
Created by admin on Sat Dec 16 17:19:16 GMT 2023 , Edited by admin on Sat Dec 16 17:19:16 GMT 2023
PRIMARY
Related Record Type Details
TRANSPORTER -> INHIBITOR