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

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H28N2O3.ClH
Molecular Weight 404.93
Optical Activity ( + )
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZOLUNICANT HYDROCHLORIDE, (+)-

SMILES

Cl.[H][C@]12[C@H](CCOC)C[C@@H]3C[N@]1CCC4=C(NC5=CC=CC=C45)[C@]2(C3)C(=O)OC

InChI

InChIKey=CVBFKKVQGICEBT-RUSJTEGESA-N
InChI=1S/C22H28N2O3.ClH/c1-26-10-8-15-11-14-12-22(21(25)27-2)19-17(7-9-24(13-14)20(15)22)16-5-3-4-6-18(16)23-19;/h3-6,14-15,20,23H,7-13H2,1-2H3;1H/t14-,15+,20+,22-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C22H28N2O3
Molecular Weight 368.4693
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:16:09 GMT 2023
Edited
by admin
on Sat Dec 16 18:16:09 GMT 2023
Record UNII
JU8HJ46LXD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZOLUNICANT HYDROCHLORIDE, (+)-
Common Name English
18-METHOXYCORONARIDINE HYDROCHLORIDE, (+)-
Common Name English
IBOGAMINE-18-CARBOXYLIC ACID, 21-METHOXY-, METHYL ESTER, MONOHYDROCHLORIDE, (2.ALPHA.,4.ALPHA.,5.BETA.,6.ALPHA.,18.BETA.)-
Systematic Name English
IBOGAMINE-18-CARBOXYLIC ACID, 21-METHOXY-, METHYL ESTER, HYDROCHLORIDE (1:1), (2.ALPHA.,4.ALPHA.,5.BETA.,6.ALPHA.,18.BETA.)-
Common Name English
(+)-18-METHOXYCORONARIDINE HYDROCHLORIDE
Common Name English
Code System Code Type Description
CAS
266686-75-3
Created by admin on Sat Dec 16 18:16:10 GMT 2023 , Edited by admin on Sat Dec 16 18:16:10 GMT 2023
PRIMARY
FDA UNII
JU8HJ46LXD
Created by admin on Sat Dec 16 18:16:10 GMT 2023 , Edited by admin on Sat Dec 16 18:16:10 GMT 2023
PRIMARY
PUBCHEM
76970974
Created by admin on Sat Dec 16 18:16:10 GMT 2023 , Edited by admin on Sat Dec 16 18:16:10 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER
PARENT -> SALT/SOLVATE