(4S)-3-CARBAMOYL-4-(4-CYANO-2-METHOXY-PHENYL)-5-ETHOXY-2,3-DIHYDROXY-2-METHYL-1,4-DIHYDRO-1,6-NAPHTHYRIDINE-8-CARBOXYLIC ACID

Details

Stereochemistry	MIXED
Molecular Formula	C21H22N4O7
Molecular Weight	442.422
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (4S)-3-CARBAMOYL-4-(4-CYANO-2-METHOXY-PHENYL)-5-ETHOXY-2,3-DIHYDROXY-2-METHYL-1,4-DIHYDRO-1,6-NAPHTHYRIDINE-8-CARBOXYLIC ACID

Structure Search

SMILES

CCOC1=NC=C(C(O)=O)C2=C1[C@H](C3=CC=C(C=C3OC)C#N)C(O)(C(N)=O)C(C)(O)N2

InChI

InChIKey=ZEARZJDOXMUTHJ-VUZGARFFSA-N

InChI=1S/C21H22N4O7/c1-4-32-17-14-15(11-6-5-10(8-22)7-13(11)31-3)21(30,19(23)28)20(2,29)25-16(14)12(9-24-17)18(26)27/h5-7,9,15,25,29-30H,4H2,1-3H3,(H2,23,28)(H,26,27)/t15-,20?,21?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H22N4O7
Molecular Weight	442.422
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	1 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:11:07 UTC 2023` Edited by `admin` on `Sat Dec 16 16:11:07 UTC 2023`
Record UNII	J89R82BS37
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(4S)-3-CARBAMOYL-4-(4-CYANO-2-METHOXY-PHENYL)-5-ETHOXY-2,3-DIHYDROXY-2-METHYL-1,4-DIHYDRO-1,6-NAPHTHYRIDINE-8-CARBOXYLIC ACID

Systematic Name

English

FINERENONE METABOLITE M8

Common Name

English

Code System Code Type Description

FDA UNII

J89R82BS37

Created by admin on Sat Dec 16 16:11:07 UTC 2023 , Edited by admin on Sat Dec 16 16:11:07 UTC 2023

PRIMARY

PUBCHEM

155929011

Created by admin on Sat Dec 16 16:11:07 UTC 2023 , Edited by admin on Sat Dec 16 16:11:07 UTC 2023

PRIMARY

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