Sempervirine cation structure

Sempervirine cation

16,17,18,19-tetrahydro-3H-yohimban-13-ium

Also Known As: Sempervirine|Sempervirine cation|sempervirin|Sempervirene|SEMPERVIRINE ION|SEMPERVIRINE ION [MI]|C19H17N2+|NP0152|TN2202|16,17,18,19-tetrahydro-3H-yohimban-13-ium|4CN-1580|2,3,4,13-tetrahydro-1h-benz[g]indolo[2,3-a]quinolizin-6-ium|3,4,5,6,14,15,20,21-octadehydroyohimbanium|2,3,4,13-Tetrahydro-1H-benz(g)indolo(2,3)quinolizin-6-ium|2,3,4,13-Tetrahydro-1H-indolo[2',3':3,4]pyrido[1,2-b]isoquinolin-6-ium|B2703-041434|YOHIMBANIUM, 3,4,5,6,14,15,20,21-OCTADEHYDRO-|1,2,3,4-TETRAHYDRO-13H-BENZ(G)INDOLO(2,3-A)QUINOLIZINIUM|1,2,3,4-tetrahydroindolo[2',3':3,4]pyrido[1,2-b]isoquinoline|1H-Benz(g)indolo(2,3)quinolizin-6-ium, 2,3,4,13-tetrahydro-|1H-BENZ(G)INDOLO(2,3-A)QUINOLIZIN-6-IUM, 2,3,4,13-TETRAHYDRO-

CAS: 80296-67-9
Molecular Formula C19H17N2+
Molecular Weight 273.13916 g/mol
LogP 5.7
Topological Polar Surface Area 19.9 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 0
Rotatable Bonds 0
Exact Mass 273.13916
Monoisotopic Mass 273.13916
Heavy Atoms 21
Complexity 395.0

Chemical Identifiers

CAS Number 80296-67-9
SMILES C1CCC2=C[N+]3=C(C=C2C1)C4=C(C=C3)C5=CC=CC=C5N4
InChIKey UQVUEULZDJRMJR-UHFFFAOYSA-O

Patent-Derived Application Labels

Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.

Pharmaceutical Intermediates (5 patents)

Product Overview

Sempervirine cation (CAS 80296-67-9), with molecular formula C19H17N2+ and molecular weight 273.13916 g/mol. IUPAC: 16,17,18,19-tetrahydro-3H-yohimban-13-ium.

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