U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H13NO10
Molecular Weight 403.2965
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QC-12

SMILES

OC(=O)CNC(=O)OC1=C(O)C=CC(=C1)C2=C(O)C(=O)C3=C(O)C=C(O)C=C3O2

InChI

InChIKey=PJHBXFNXVPBOAI-UHFFFAOYSA-N
InChI=1S/C18H13NO10/c20-8-4-10(22)14-12(5-8)28-17(16(26)15(14)25)7-1-2-9(21)11(3-7)29-18(27)19-6-13(23)24/h1-5,20-22,26H,6H2,(H,19,27)(H,23,24)

HIDE SMILES / InChI

Approval Year

Name Type Language
QC-12
Common Name English
2-((2-HYDROXY-5-(3,5,7-TRIHYDROXY-4-OXO-CHROMEN-2-YL)PHENOXY)CARBONYLAMINO)ACETIC ACID
Systematic Name English
GLYCINE, N-((2-HYDROXY-5-(3,5,7-TRIHYDROXY-4-OXO-4H-1-BENZOPYRAN-2-YL)PHENOXY)CARBONYL)-
Systematic Name English
Code System Code Type Description
CAS
201280-73-1
Created by admin on Sat Dec 16 11:47:16 GMT 2023 , Edited by admin on Sat Dec 16 11:47:16 GMT 2023
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FDA UNII
9UA2FPZ3ZK
Created by admin on Sat Dec 16 11:47:16 GMT 2023 , Edited by admin on Sat Dec 16 11:47:16 GMT 2023
PRIMARY
PUBCHEM
9844095
Created by admin on Sat Dec 16 11:47:16 GMT 2023 , Edited by admin on Sat Dec 16 11:47:16 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545140
Created by admin on Sat Dec 16 11:47:16 GMT 2023 , Edited by admin on Sat Dec 16 11:47:16 GMT 2023
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