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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H19BrN2
Molecular Weight 319.239
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17-BROMOFESTUCLAVINE

SMILES

CN1C[C@H](CBr)C[C@H]2[C@H]1CC3=CNC4=C3C2=CC=C4

InChI

InChIKey=NRNPZUVPUBSFMI-PSOPSSQASA-N
InChI=1S/C16H19BrN2/c1-19-9-10(7-17)5-13-12-3-2-4-14-16(12)11(8-18-14)6-15(13)19/h2-4,8,10,13,15,18H,5-7,9H2,1H3/t10-,13+,15+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
17-BROMOFESTUCLAVINE
Common Name English
D-8.BETA.-(BROMOMETHYL)-6-METHYLERGOLINE
Preferred Name English
ERGOLINE, 8-(BROMOMETHYL)-6-METHYL-, (8.BETA.)
Common Name English
Code System Code Type Description
PUBCHEM
146019359
Created by admin on Wed Apr 02 06:52:47 GMT 2025 , Edited by admin on Wed Apr 02 06:52:47 GMT 2025
PRIMARY
CAS
52517-34-7
Created by admin on Wed Apr 02 06:52:47 GMT 2025 , Edited by admin on Wed Apr 02 06:52:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID00966955
Created by admin on Wed Apr 02 06:52:47 GMT 2025 , Edited by admin on Wed Apr 02 06:52:47 GMT 2025
PRIMARY
FDA UNII
UR16772D9U
Created by admin on Wed Apr 02 06:52:47 GMT 2025 , Edited by admin on Wed Apr 02 06:52:47 GMT 2025
PRIMARY