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Technical details about Tetraglyceryl monooleate, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: Oleic acid, monoester with triglycerol, 33940-98-6, [3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-hydroxypropyl] (z)-octadec-9-enoate, 9-octadecenoic acid (z)-, monoester with triglycerol, Caprol 3go, Sunsoft a-17c
Molecular Formula
C27H52O8
Molecular Weight
504.7  g/mol
InChI Key
SJLAFUFWXUJDDR-KTKRTIGZSA-N
FDA UNII
XRQ165498B

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-hydroxypropyl] (Z)-octadec-9-enoate
2.1.2 InChI
InChI=1S/C27H52O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27(32)35-23-26(31)22-34-21-25(30)20-33-19-24(29)18-28/h9-10,24-26,28-31H,2-8,11-23H2,1H3/b10-9-
2.1.3 InChI Key
SJLAFUFWXUJDDR-KTKRTIGZSA-N
2.1.4 Canonical SMILES
CCCCCCCCC=CCCCCCCCC(=O)OCC(COCC(COCC(CO)O)O)O
2.1.5 Isomeric SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OCC(COCC(COCC(CO)O)O)O
2.2 Other Identifiers
2.2.1 UNII
XRQ165498B
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Oleic Acid, Monoester With Triglycerol

2. 33940-98-6

3. [3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]-2-hydroxypropyl] (z)-octadec-9-enoate

4. 9-octadecenoic Acid (z)-, Monoester With Triglycerol

5. Caprol 3go

6. Sunsoft A-17c

7. Isolan Go 33

8. Sunsoft A-171c

9. Triglycerin Monooleate

10. Schembl18067435

11. Aec Polyglyceryl-3 Oleate

12. Xrq165498b

13. Polyglyceryl-3 Oleate [ii]

14. Polyglyceryl-3 Oleate [inci]

15. Oleic Acid, Monoester With Triglycerol, Aldrichcpr

16. Oleic Acid 2,6,10,11-tetrahydroxy-4,8-dioxaundecane-1-yl Ester

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 504.7 g/mol
Molecular Formula C27H52O8
XLogP34.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count8
Rotatable Bond Count27
Exact Mass504.36621861 g/mol
Monoisotopic Mass504.36621861 g/mol
Topological Polar Surface Area126 Ų
Heavy Atom Count35
Formal Charge0
Complexity486
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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