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

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H18N2O
Molecular Weight 254.3269
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SETOCLAVINE

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)C1=C[C@](C)(O)CN2C

InChI

InChIKey=BGVUWLLRNRBDAY-ZBFHGGJFSA-N
InChI=1S/C16H18N2O/c1-16(19)7-12-11-4-3-5-13-15(11)10(8-17-13)6-14(12)18(2)9-16/h3-5,7-8,14,17,19H,6,9H2,1-2H3/t14-,16+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SETOCLAVINE
Common Name English
SETOCLAVIN
Common Name English
ERGOLIN-8.ALPHA.-OL, 9,10-DIDEHYDRO-6,8-DIMETHYL-
Systematic Name English
J13.979C
Code English
ERGOLIN-8-OL, 9,10-DIDEHYDRO-6,8-DIMETHYL-, (8.ALPHA.)-
Systematic Name English
9,10-DIDEHYDRO-6,8-DIMETHYLERGOLIN-8.ALPHA.-OL
Systematic Name English
(+)-SETOCLAVINE
Common Name English
Code System Code Type Description
CAS
519-12-0
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
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EPA CompTox
DTXSID301256140
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY
WIKIPEDIA
SETOCLAVINE
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY
PUBCHEM
11482216
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY
FDA UNII
UE9HT9P885
Created by admin on Sat Dec 16 10:53:33 GMT 2023 , Edited by admin on Sat Dec 16 10:53:33 GMT 2023
PRIMARY