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Details

Stereochemistry RACEMIC
Molecular Formula C57H100O6
Molecular Weight 881.4003
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 5
Charge 0

SHOW SMILES / InChI
Structure of 1,2-DILINOLEOYL-3-OLEIN

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC

InChI

InChIKey=VVEBTVMJPTZDHO-WECKWCTPSA-N
InChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16,18-19,21,25-30,54H,4-15,17,20,22-24,31-53H2,1-3H3/b19-16-,21-18-,28-25-,29-26-,30-27-

HIDE SMILES / InChI

Molecular Formula C57H100O6
Molecular Weight 881.4003
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 5
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:33:12 GMT 2023
Edited
by admin
on Sat Dec 16 11:33:12 GMT 2023
Record UNII
CKD0SUX495
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2-DILINOLEOYL-3-OLEIN
Common Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, 1,1'-(1-((((9Z)-1-OXO-9-OCTADECEN-1-YL)OXY)METHYL)-1,2-ETHANEDIYL) ESTER
Systematic Name English
GLYCERYL 2,3-DILINOLEATE-1-OLEATE
Systematic Name English
9,12-OCTADECADIENOIC ACID (9Z,12Z)-, 1-((((9Z)-1-OXO-9-OCTADECENYL)OXY)METHYL)-1,2-ETHANEDIYL ESTER
Systematic Name English
LINOLEIN, 3-OLEO-1,2-DI-
Systematic Name English
1,2-DILINOLEOYL-3-OLEOYL-RAC-GLYCEROL
Systematic Name English
9,12-OCTADECADIENOIC ACID (Z,Z)-, 1-(((1-OXO-9-OCTADECENYL)OXY)METHYL)-1,2-ETHANEDIYL ESTER, (Z)-
Systematic Name English
3-OLEO-1,2-DILINOLEIN
Systematic Name English
SESAME OIL RELATED COMPOUND A [USP-RS]
Common Name English
1-OLEO-2,3-DILINOLEIN
Systematic Name English
2,3-DILINOLEO-1-OLEIN
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID001287930
Created by admin on Sat Dec 16 11:33:13 GMT 2023 , Edited by admin on Sat Dec 16 11:33:13 GMT 2023
PRIMARY
RS_ITEM_NUM
1612415
Created by admin on Sat Dec 16 11:33:13 GMT 2023 , Edited by admin on Sat Dec 16 11:33:13 GMT 2023
PRIMARY
CAS
2190-21-8
Created by admin on Sat Dec 16 11:33:13 GMT 2023 , Edited by admin on Sat Dec 16 11:33:13 GMT 2023
PRIMARY
FDA UNII
CKD0SUX495
Created by admin on Sat Dec 16 11:33:13 GMT 2023 , Edited by admin on Sat Dec 16 11:33:13 GMT 2023
PRIMARY
PUBCHEM
9544291
Created by admin on Sat Dec 16 11:33:13 GMT 2023 , Edited by admin on Sat Dec 16 11:33:13 GMT 2023
PRIMARY
Related Record Type Details
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