BIA 3-270

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H13NO5
Molecular Weight	287.2674
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(O)C(=CC(=C1)C(=O)CC2=CC=CC=C2)[N+]([O-])=O

InChI

InChIKey=YXOCIHUZZWIPHW-UHFFFAOYSA-N

InChI=1S/C15H13NO5/c1-21-14-9-11(8-12(15(14)18)16(19)20)13(17)7-10-5-3-2-4-6-10/h2-6,8-9,18H,7H2,1H3

HIDE SMILES / InChI

Molecular Formula	C15H13NO5
Molecular Weight	287.2674
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:12:47 GMT 2023` Edited by `admin` on `Sat Dec 16 16:12:47 GMT 2023`
Record UNII	C2VOP33080
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BIA 3-270

Code

English

ETHANONE, 1-(4-HYDROXY-3-METHOXY-5-NITROPHENYL)-2-PHENYL-

Systematic Name

English

1-(4-HYDROXY-3-METHOXY-5-NITROPHENYL)-2-PHENYLETHANONE

Systematic Name

English

Code System Code Type Description

FDA UNII

C2VOP33080

Created by admin on Sat Dec 16 16:12:47 GMT 2023 , Edited by admin on Sat Dec 16 16:12:47 GMT 2023

PRIMARY

CAS

274925-97-2

Created by admin on Sat Dec 16 16:12:47 GMT 2023 , Edited by admin on Sat Dec 16 16:12:47 GMT 2023

PRIMARY

PUBCHEM

10902243

Created by admin on Sat Dec 16 16:12:47 GMT 2023 , Edited by admin on Sat Dec 16 16:12:47 GMT 2023

PRIMARY

Related Record Type Details


					NM2KXJ990T

NEBICAPONE

PARENT -> METABOLITE

Interaction Type:

MAJOR

Qualification:

PLASMA

Amount:

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
Tmax	PHARMACOKINETIC