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Details

Stereochemistry ACHIRAL
Molecular Formula C15H18O7
Molecular Weight 310.2992
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(4,5-DIMETHOXY-2-METHYL-3,6-DIOXO-1,4-CYCLOHEXADIEN-1-YL)-6-OXOHEXANOIC ACID

SMILES

COC1=C(OC)C(=O)C(C(=O)CCCCC(O)=O)=C(C)C1=O

InChI

InChIKey=NYCZXGXBAJEDRI-UHFFFAOYSA-N
InChI=1S/C15H18O7/c1-8-11(9(16)6-4-5-7-10(17)18)13(20)15(22-3)14(21-2)12(8)19/h4-7H2,1-3H3,(H,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
6-(4,5-DIMETHOXY-2-METHYL-3,6-DIOXO-1,4-CYCLOHEXADIEN-1-YL)-6-OXOHEXANOIC ACID
Systematic Name English
NSC-363802
Preferred Name English
1,4-CYCLOHEXADIENE-1-HEXANOIC ACID, 4,5-DIMETHOXY-2-METHYL-.EPSILON.,3,6-TRIOXO-
Systematic Name English
4,5-DIMETHOXY-2-METHYL-.EPSILON.,3,6-TRIOXO-1,4-CYCLOHEXADIENE-1-HEXANOIC ACID
Systematic Name English
Code System Code Type Description
CAS
58185-91-4
Created by admin on Tue Apr 01 20:11:47 GMT 2025 , Edited by admin on Tue Apr 01 20:11:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID70206911
Created by admin on Tue Apr 01 20:11:47 GMT 2025 , Edited by admin on Tue Apr 01 20:11:47 GMT 2025
PRIMARY
FDA UNII
SNX7MWP9LK
Created by admin on Tue Apr 01 20:11:47 GMT 2025 , Edited by admin on Tue Apr 01 20:11:47 GMT 2025
PRIMARY
NSC
363802
Created by admin on Tue Apr 01 20:11:47 GMT 2025 , Edited by admin on Tue Apr 01 20:11:47 GMT 2025
PRIMARY
PUBCHEM
338946
Created by admin on Tue Apr 01 20:11:47 GMT 2025 , Edited by admin on Tue Apr 01 20:11:47 GMT 2025
PRIMARY
NIH
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