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Details

Stereochemistry RACEMIC
Molecular Formula C63H118O12
Molecular Weight 1067.6038
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIOCTANOYL PENTAERYTHRITYL DISTEARYL CITRATE

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CC(O)(CC(=O)OCC(CO)(COC(=O)CCCCCCC)COC(=O)CCCCCCC)C(=O)OCCCCCCCCCCCCCCCCCC

InChI

InChIKey=BIZDPJWSBNBDNZ-UHFFFAOYSA-N
InChI=1S/C63H118O12/c1-5-9-13-17-19-21-23-25-27-29-31-33-35-37-41-45-49-71-59(67)51-63(70,61(69)72-50-46-42-38-36-34-32-30-28-26-24-22-20-18-14-10-6-2)52-60(68)75-56-62(53-64,54-73-57(65)47-43-39-15-11-7-3)55-74-58(66)48-44-40-16-12-8-4/h64,70H,5-56H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C63H118O12
Molecular Weight 1067.6038
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
VN7522JPKQ
Record Status Validated (UNII)
Record Version