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Details

Stereochemistry ACHIRAL
Molecular Formula C19H32O3
Molecular Weight 308.4556
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methyl-5-pentyl-2-furannonanoic acid

SMILES

CCCCCC1=CC(C)=C(CCCCCCCCC(O)=O)O1

InChI

InChIKey=TUQVXFOSXOCQCM-UHFFFAOYSA-N
InChI=1S/C19H32O3/c1-3-4-9-12-17-15-16(2)18(22-17)13-10-7-5-6-8-11-14-19(20)21/h15H,3-14H2,1-2H3,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C19H32O3
Molecular Weight 308.4556
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 15:33:02 GMT 2023
Edited
by admin
on Sat Dec 16 15:33:02 GMT 2023
Record UNII
D8FS6VUD44
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Methyl-5-pentyl-2-furannonanoic acid
Systematic Name English
9-(3-Methyl-5-pentyl-furan-2-yl)nonanoic acid
Systematic Name English
2-Furannonanoic acid, 3-methyl-5-pentyl-
Systematic Name English
9-(3-Methyl-5-pentylfuran-2-yl)nonanoic acid
Systematic Name English
Code System Code Type Description
FDA UNII
D8FS6VUD44
Created by admin on Sat Dec 16 15:33:02 GMT 2023 , Edited by admin on Sat Dec 16 15:33:02 GMT 2023
PRIMARY
PUBCHEM
3085134
Created by admin on Sat Dec 16 15:33:02 GMT 2023 , Edited by admin on Sat Dec 16 15:33:02 GMT 2023
PRIMARY
CAS
57818-39-0
Created by admin on Sat Dec 16 15:33:02 GMT 2023 , Edited by admin on Sat Dec 16 15:33:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID10206531
Created by admin on Sat Dec 16 15:33:02 GMT 2023 , Edited by admin on Sat Dec 16 15:33:02 GMT 2023
PRIMARY