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

Details

Stereochemistry ABSOLUTE
Molecular Formula C21H26N2O3
Molecular Weight 354.4427
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 18-HYDROXYCORONARIDINE

SMILES

COC(=O)[C@@]12C[C@H]3C[C@H](CCO)[C@@H]1[N@](C3)CCC4=C2NC5=C4C=CC=C5

InChI

InChIKey=FRCVRUHRFLXLAI-PZXGUROGSA-N
InChI=1S/C21H26N2O3/c1-26-20(25)21-11-13-10-14(7-9-24)19(21)23(12-13)8-6-16-15-4-2-3-5-17(15)22-18(16)21/h2-5,13-14,19,22,24H,6-12H2,1H3/t13-,14+,19+,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H26N2O3
Molecular Weight 354.4427
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 Wed Apr 02 06:58:52 GMT 2025
Edited
by admin
on Wed Apr 02 06:58:52 GMT 2025
Record UNII
WD3MZG9WTB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALBIFLORANINE
Preferred Name English
18-HYDROXYCORONARIDINE
Common Name English
METHYL 21-HYDROXYIBOGAMINE-18-CARBOXYLATE
Common Name English
IBOGAMINE-18-CARBOXYLIC ACID, 21-HYDROXY-, METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
WD3MZG9WTB
Created by admin on Wed Apr 02 06:58:52 GMT 2025 , Edited by admin on Wed Apr 02 06:58:52 GMT 2025
PRIMARY
EPA CompTox
DTXSID60228147
Created by admin on Wed Apr 02 06:58:52 GMT 2025 , Edited by admin on Wed Apr 02 06:58:52 GMT 2025
PRIMARY
PUBCHEM
157061
Created by admin on Wed Apr 02 06:58:52 GMT 2025 , Edited by admin on Wed Apr 02 06:58:52 GMT 2025
PRIMARY
CAS
77431-58-4
Created by admin on Wed Apr 02 06:58:52 GMT 2025 , Edited by admin on Wed Apr 02 06:58:52 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR