ISOAPO-.BETA.-ERYTHROIDINE

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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

Structure Search

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

Molecular Formula	C15H15NO2
Molecular Weight	241.2851
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:05:58 GMT 2025` Edited by `admin` on `Mon Mar 31 22:05:58 GMT 2025`
Record UNII	B1B2SN522D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOAPO-.BETA.-ERYTHROIDINE [MI]

Preferred Name

English

ISOAPO-.BETA.-ERYTHROIDINE

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 Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

PRIMARY

PUBCHEM

17411

Created by admin on Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

PRIMARY

EPA CompTox

DTXSID20948713

Created by admin on Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

PRIMARY

CAS

2581-07-9

Created by admin on Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

PRIMARY

CAS

408525-19-9

Created by admin on Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

ALTERNATIVE

MERCK INDEX

m781

Created by admin on Mon Mar 31 22:05:58 GMT 2025 , Edited by admin on Mon Mar 31 22:05:58 GMT 2025

PRIMARY

Merck Index