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

Details

Stereochemistry RACEMIC
Molecular Formula C15H15NO2
Molecular Weight 241.2851
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOAPO-.BETA.-ERYTHROIDINE

SMILES

O=C1OCC2CCN3CCC4=C3C(=CC=C4)C2=C1

InChI

InChIKey=NFHDHFOAEACPDR-UHFFFAOYSA-N
InChI=1S/C15H15NO2/c17-14-8-13-11(9-18-14)5-7-16-6-4-10-2-1-3-12(13)15(10)16/h1-3,8,11H,4-7,9H2

HIDE SMILES / InChI

Approval Year

Name Type Language
ISOAPO-.BETA.-ERYTHROIDINE
MI  
Common Name English
ISOAPO-.BETA.-ERYTHROIDINE [MI]
Common Name English
AZEPINO(3,2,1-HI)INDOLE-.DELTA.7(4H),.ALPHA.-ACETIC ACID, 1,2,5,6-TETRAHYDRO-6-(HYDROXYMETHYL)-, .DELTA.-LACTONE
Systematic Name English
11H-PYRANO(3,4-D)PYRROLO(3,2,1-JK)(1)BENZAZEPIN-11-ONE, 4,5,7,8,8A,9-HEXAHYDRO-
Systematic Name English
Code System Code Type Description
FDA UNII
B1B2SN522D
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
PRIMARY
PUBCHEM
17411
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
PRIMARY
EPA CompTox
DTXSID20948713
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
PRIMARY
CAS
2581-07-9
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
PRIMARY
CAS
408525-19-9
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
ALTERNATIVE
MERCK INDEX
m781
Created by admin on Sat Dec 16 08:28:14 GMT 2023 , Edited by admin on Sat Dec 16 08:28:14 GMT 2023
PRIMARY Merck Index