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Details

Stereochemistry RACEMIC
Molecular Formula C27H46O10
Molecular Weight 530.6481
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GLYCERYL 1-CITRATE 3-OLEATE

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)OCC(O)COC(=O)CC(O)(CC(O)=O)C(O)=O

InChI

InChIKey=AYWFRASSBQKOLK-KTKRTIGZSA-N
InChI=1S/C27H46O10/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(31)36-20-22(28)21-37-25(32)19-27(35,26(33)34)18-23(29)30/h9-10,22,28,35H,2-8,11-21H2,1H3,(H,29,30)(H,33,34)/b10-9-

HIDE SMILES / InChI

Approval Year

Name Type Language
GLYCERYL 1-CITRATE 3-OLEATE
Common Name English
1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, 1-(2-HYDROXY-3-(((9Z)-1-OXO-9-OCTADECEN-1-YL)OXY)PROPYL) ESTER
Systematic Name English
1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, 1-(2-HYDROXY-3-((1-OXO-9-OCTADECENYL)OXY)PROPYL) ESTER, (Z)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801122946
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
PRIMARY
CAS
732208-18-3
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
PRIMARY
CAS
97645-27-7
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
94GSU1LR0S
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
PRIMARY
PUBCHEM
119058023
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
PRIMARY
ECHA (EC/EINECS)
307-425-3
Created by admin on Sat Dec 16 11:37:21 GMT 2023 , Edited by admin on Sat Dec 16 11:37:21 GMT 2023
PRIMARY