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

Details

Stereochemistry	MIXED
Molecular Formula	C21H24N4O6
Molecular Weight	428.4385
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

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

InChI

InChIKey=LQIVKRWKLBOTKN-ATIQYGATSA-N

InChI=1S/C21H24N4O6/c1-4-31-18-15-16(13-6-5-11(8-22)7-14(13)30-3)21(29,19(23)27)20(2,28)25-17(15)12(10-26)9-24-18/h5-7,9,16,25-26,28-29H,4,10H2,1-3H3,(H2,23,27)/t16-,20?,21?/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H24N4O6
Molecular Weight	428.4385
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 16:34:10 UTC 2023` Edited by `admin` on `Sat Dec 16 16:34:10 UTC 2023`
Record UNII	CW6UE4TAF8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Systematic Name

English

FINERENONE METABOLITE M5

Common Name

English

Code System Code Type Description

FDA UNII

CW6UE4TAF8

Created by admin on Sat Dec 16 16:34:11 UTC 2023 , Edited by admin on Sat Dec 16 16:34:11 UTC 2023

PRIMARY

PUBCHEM

156596817

Created by admin on Sat Dec 16 16:34:11 UTC 2023 , Edited by admin on Sat Dec 16 16:34:11 UTC 2023

PRIMARY

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