U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C28H54O5
Molecular Weight 470.7254
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIISODODECYL MALATE

SMILES

CC(C)CCCCCCCCCOC(=O)CC(O)C(=O)OCCCCCCCCCC(C)C

InChI

InChIKey=ZAXDTZBITHWJPQ-UHFFFAOYSA-N
InChI=1S/C28H54O5/c1-24(2)19-15-11-7-5-9-13-17-21-32-27(30)23-26(29)28(31)33-22-18-14-10-6-8-12-16-20-25(3)4/h24-26,29H,5-23H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C28H54O5
Molecular Weight 470.7254
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
6R0ZF579WS
Record Status Validated (UNII)
Record Version