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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26N2O6S
Molecular Weight 470.538
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEMETHYL-HYDROXY-EVATANEPAG

SMILES

CC(C)(O)C1=CC=C(CN(CC2=CC(OCC(O)=O)=CC=C2)S(=O)(=O)C3=CN=CC=C3)C=C1

InChI

InChIKey=QCKBNFRFJGPPNF-UHFFFAOYSA-N
InChI=1S/C24H26N2O6S/c1-24(2,29)20-10-8-18(9-11-20)15-26(33(30,31)22-7-4-12-25-14-22)16-19-5-3-6-21(13-19)32-17-23(27)28/h3-14,29H,15-17H2,1-2H3,(H,27,28)

HIDE SMILES / InChI

Molecular Formula C24H26N2O6S
Molecular Weight 470.538
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:34:28 GMT 2023
Edited
by admin
on Sat Dec 16 16:34:28 GMT 2023
Record UNII
54SH4M23T6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEMETHYL-HYDROXY-EVATANEPAG
Common Name English
ACETIC ACID, 2-(3-((((4-(1-HYDROXY-1-METHYLETHYL)PHENYL)METHYL)(3-PYRIDINYLSULFONYL)AMINO)METHYL)PHENOXY)-
Systematic Name English
CP-533,536 METABOLITE M23
Common Name English
2-(3-((((4-(1-HYDROXY-1-METHYLETHYL)PHENYL)METHYL)(3-PYRIDINYLSULFONYL)AMINO)METHYL)PHENOXY)ACETIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
54SH4M23T6
Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023
PRIMARY
CAS
574759-38-9
Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023
PRIMARY
PUBCHEM
10310827
Created by admin on Sat Dec 16 16:34:28 GMT 2023 , Edited by admin on Sat Dec 16 16:34:28 GMT 2023
PRIMARY
Related Record Type Details
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