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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

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

Approval Year

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 GMT 2023 , Edited by admin on Sat Dec 16 16:34:11 GMT 2023
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PUBCHEM
156596817
Created by admin on Sat Dec 16 16:34:11 GMT 2023 , Edited by admin on Sat Dec 16 16:34:11 GMT 2023
PRIMARY