Structural formula of Triolein-1,1,1-13C3

Triolein-1,1,1-13C3

Product number: 78-1891
CAS number: 82005-46-7
Synonyms: 9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (Z,Z,Z)-, 13C-Triolein

Identifiers

CAS Index Name: 9-Octadecenoic-1-13C acid, 1,2,3-propanetriyl ester, (9Z,9′Z,9′′Z)-
Molecular formula: C57H104O6
Molecular weight: 888.41
Smiles: O=C(OCC(OC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC)CCCCCCCC=CCCCCCCCC
Isomeric Smiles: C(O[13C](CCCCCCCC=CCCCCCCCC)=O)(CO[13C](CCCCCCCC=CCCCCCCCC)=O)CO[13C](CCCCCCCC=CCCCCCCCC)=O
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
InChIKey: InChIKey=PHYFQTYBJUILEZ-UBEHWWNBSA-N

Product information

Purity: >98%
Storage: Freezer
Supplied as: Neat
Physical state: Liquid
Documentation: Certificate of Analysis
MSDS: Ask for MSDS

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78-1891-12Triolein-1,1,1-13C3 - 500 mg1,058.00
78-1891-7Triolein-1,1,1-13C3 - 25 mg286.00
78-1891-9Triolein-1,1,1-13C3 - 100 mg549.00