CPA-926

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C17H19NO9
Molecular Weight	381.3341
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(=O)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1OC2=CC3=C(OC(=O)C=C3)C=C2O

InChI

InChIKey=OTXAWKXSJDFGID-LMHBHQSJSA-N

InChI=1S/C17H19NO9/c1-7(20)18-14-16(24)15(23)12(6-19)27-17(14)26-11-4-8-2-3-13(22)25-10(8)5-9(11)21/h2-5,12,14-17,19,21,23-24H,6H2,1H3,(H,18,20)/t12-,14-,15-,16-,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C17H19NO9
Molecular Weight	381.3341
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 `Sat Dec 16 10:16:19 GMT 2023` Edited by `admin` on `Sat Dec 16 10:16:19 GMT 2023`
Record UNII	3FV7EH3G97
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

CPA-926

Common Name

English

2H-1-BENZOPYRAN-2-ONE, 6-((2-(ACETYLAMINO)-2-DEOXY-.BETA.-D-GLUCOPYRANOSYL)OXY)-7-HYDROXY-

Systematic Name

English

CPA 926

Code

English

Code System Code Type Description

FDA UNII

3FV7EH3G97

Created by admin on Sat Dec 16 10:16:19 GMT 2023 , Edited by admin on Sat Dec 16 10:16:19 GMT 2023

PRIMARY

CAS

169673-60-3

Created by admin on Sat Dec 16 10:16:19 GMT 2023 , Edited by admin on Sat Dec 16 10:16:19 GMT 2023

PRIMARY

PUBCHEM

9800054

Created by admin on Sat Dec 16 10:16:19 GMT 2023 , Edited by admin on Sat Dec 16 10:16:19 GMT 2023

PRIMARY

Related Record Type Details


					SM2XD6V944

ESCULETIN

METABOLITE ACTIVE -> PRODRUG

Comments:

OBJECTIVE: To investigate the in vitro effects of 6,7-dihydroxycoumarin(esculetin) on the production of matrix metalloproteinases (MMP) in rabbit articular cartilage, and the in vivo effects of orally administered CPA-926, a prodrug of esculetin, on cartilage destruction in rabbit experimental osteoarthritis (OA).

Related Record Type Details


					3FV7EH3G97

CPA-926

ACTIVE MOIETY