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

Details

Stereochemistry ABSOLUTE
Molecular Formula C13H15NO2
Molecular Weight 217.2637
Optical Activity ( + )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VIROSECURININE

SMILES

[H][C@@]12CCCCN1[C@@H]3C[C@]24OC(=O)C=C4C=C3

InChI

InChIKey=SWZMSZQQJRKFBP-GMXVVIOVSA-N
InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11-,13+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
VIROSECURININE
Common Name English
8H-6,11B-METHANOFURO(2,3-C)PYRIDO(1,2-A)AZEPIN-2(6H)-ONE, 9,10,11,11A-TETRAHYDRO-, (6R-(6.ALPHA.,11A.BETA.,11B.ALPHA.))-
Systematic Name English
VIROSECURININ
Common Name English
(6R,11AS,11BR)-9,10,11,11A-TETRAHYDRO-8H-6,11B-METHANOFURO(2,3-C)PYRIDO(1,2-A)AZEPIN-2(6H)-ONE
Systematic Name English
8H-6,11B-METHANOFURO(2,3-C)PYRIDO(1,2-A)AZEPIN-2(6H)-ONE, 9,10,11,11A-TETRAHYDRO-, (6R,11AS,11BR)-
Systematic Name English
2.ALPHA.,7.ALPHA.-SECURININE
Common Name English
D-SECURININE
Common Name English
NSC-107414
Code English
(+)-VIROSECURININE
Common Name English
SECURINAN-11-ONE, (2.ALPHA.,7.BETA.,9.BETA.)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID901316136
Created by admin on Fri Dec 15 16:06:42 GMT 2023 , Edited by admin on Fri Dec 15 16:06:42 GMT 2023
PRIMARY
FDA UNII
D05X6H4208
Created by admin on Fri Dec 15 16:06:42 GMT 2023 , Edited by admin on Fri Dec 15 16:06:42 GMT 2023
PRIMARY
PUBCHEM
928095
Created by admin on Fri Dec 15 16:06:42 GMT 2023 , Edited by admin on Fri Dec 15 16:06:42 GMT 2023
PRIMARY
CAS
6704-68-3
Created by admin on Fri Dec 15 16:06:42 GMT 2023 , Edited by admin on Fri Dec 15 16:06:42 GMT 2023
PRIMARY
NSC
107414
Created by admin on Fri Dec 15 16:06:42 GMT 2023 , Edited by admin on Fri Dec 15 16:06:42 GMT 2023
PRIMARY