AG00G4FL

Name: Triolein-13C3
Brand: Angene Chemical
SKU: AG00G4FL

82005-46-7 | Triolein-13C3

AG00G4FL

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CAS Number	82005-46-7
Catalog Number	AG00G4FL(AGN-PC-0UL7LW)
Chemical Name	Triolein-13C3
IUPAC Name	2,3-bis[[(Z)-(113C)octadec-9-enoyl]oxy]propyl (Z)-(113C)octadec-9-enoate
InChI	InChI=1S/C57H104O6/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/h25-30,54H,4-24,31-53H2,1-3H3/b28-25-,29-26-,30-27-/i55+1,56+1,57+1
InChI Key	PHYFQTYBJUILEZ-UBEHWWNBSA-N
MDL Number	MFCD00145462
Molecular Formula	C57H104O6
Molecular Weight	888.4100
SMILES	C(CO[13C](=O)CCCCCCC/C=CCCCCCCCC)(CO[13C](=O)CCCCCCC/C=CCCCCCCCC)O[13C](=O)CCCCCCC/C=CCCCCCCCC
Synonyms	Glyceryl tri(oleate-1-13C), 82005-46-7, Triolein 13C, Glyceryl tri(oleate-1-13C), 99 atom % 13C, 98% (CP), 9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (Z,Z,Z)-, Glyceryl tri(oleate-1-13C), S & P tested, 99 atom % 13C, 98% (CP), Triolein 13C3, GLYCERYLTRI, CS-BE-00031,

Complexity	1010
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	3
Exact Mass	887.793g/mol
Formal Charge	0
Heavy Atom Count	63
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	3
Molecular Weight	888.43g/mol
Monoisotopic Mass	887.793g/mol
Rotatable Bond Count	53
Topological Polar Surface Area	78.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	22.4

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited