AB-001

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H24O6
Molecular Weight	396.4331
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure of AB-001

Structure Search

SMILES

COC1=CC(\C=C\C(=O)\C=C\C=C\C2=CC(OC)=C(O)C(OC)=C2)=CC(OC)=C1

InChI

InChIKey=LJSMCOGLALRQKD-BISOHRNISA-N

InChI=1S/C23H24O6/c1-26-19-11-17(12-20(15-19)27-2)9-10-18(24)8-6-5-7-16-13-21(28-3)23(25)22(14-16)29-4/h5-15,25H,1-4H3/b7-5+,8-6+,10-9+

HIDE SMILES / InChI

Molecular Formula	C23H24O6
Molecular Weight	396.4331
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	3
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 16:14:57 GMT 2025` Edited by `admin` on `Wed Apr 02 16:14:57 GMT 2025`
Record UNII	TNM7KA4LB3
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

AB001

Preferred Name

English

AB-001

Code

English

1,4,6-Heptatrien-3-one, 1-(3,5-dimethoxyphenyl)-7-(4-hydroxy-3,5-dimethoxyphenyl)-, (1E,4E,6E)-

Systematic Name

English

(1E,4E,6E)-1-(3,5-dimethoxyphenyl)-7-(4-hydroxy-3,5dimethoxyphenyl)hepta-1,4,6-trien-3-one

Systematic Name

English

(1E, 4E, 6E)-1-(3, 5-dimethoxyphenyl)-7-(4-hydroxy-3, 5 dimethoxyphenyl) hepta-1, 4, 6-trien-3-one

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

870922

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

FDA ORPHAN DRUG

870822

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

FDA ORPHAN DRUG

876722

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

Code System Code Type Description

PUBCHEM

154728220

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

PRIMARY

CAS

2663700-89-6

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

PRIMARY

FDA UNII

TNM7KA4LB3

Created by admin on Wed Apr 02 16:14:57 GMT 2025 , Edited by admin on Wed Apr 02 16:14:57 GMT 2025

PRIMARY

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