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Details

Stereochemistry ACHIRAL
Molecular Formula C22H38O3
Molecular Weight 350.5353
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-Dimethyl-5-pentyl-2-furanundecanoic acid

SMILES

CCCCCC1=C(C)C(C)=C(CCCCCCCCCCC(O)=O)O1

InChI

InChIKey=MCTXSZNBSIMKTO-UHFFFAOYSA-N
InChI=1S/C22H38O3/c1-4-5-12-15-20-18(2)19(3)21(25-20)16-13-10-8-6-7-9-11-14-17-22(23)24/h4-17H2,1-3H3,(H,23,24)

HIDE SMILES / InChI

Molecular Formula C22H38O3
Molecular Weight 350.5353
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 15:31:26 GMT 2023
Edited
by admin
on Sat Dec 16 15:31:26 GMT 2023
Record UNII
WBZ3SVM6H5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-Dimethyl-5-pentyl-2-furanundecanoic acid
Systematic Name English
11-(3,4-Dimethyl-5-pentylfuran-2-yl)undecanoic acid
Systematic Name English
11-(3,4-Dimethyl-5-pentyl-furan-2-yl)undecanoic acid
Systematic Name English
2-Furanundecanoic acid, 3,4-dimethyl-5-pentyl-
Systematic Name English
Code System Code Type Description
PUBCHEM
13963867
Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023
PRIMARY
CAS
57818-36-7
Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023
PRIMARY
EPA CompTox
DTXSID80553387
Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023
PRIMARY
FDA UNII
WBZ3SVM6H5
Created by admin on Sat Dec 16 15:31:26 GMT 2023 , Edited by admin on Sat Dec 16 15:31:26 GMT 2023
PRIMARY