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3-[(3-O-Hexopyranosylhexopyranosyl)oxy]-2-[(14-methylpentadecanoyl)oxy]propyl 14-methylhexadecanoate

HCID 190861
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
156957-28-7
Standard SMILES
CCC(C)CCCCCCCCCCCCC(=O)OCC(CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O)OC(=O)CCCCCCCCCCCCC(C)C
InChIKey
HDFSOYPNMIVZMT-WKKKTHSJSA-N
Molecular formula
C48H90O15
Average molar mass
907.233 g/mol
Monoisotopic mass
906.62797218

Names & identifiers

Preferred name
3-[(3-O-Hexopyranosylhexopyranosyl)oxy]-2-[(14-methylpentadecanoyl)oxy]propyl 14-methylhexadecanoate
IUPAC
3-[(3-O-alpha-D-Glucopyranosyl-alpha-D-mannopyranosyl)oxy]-2-[(14-methylpentadecanoyl)oxy]propyl 14-methylhexadecanoate
English name
BF-7 diglycosyl diacylglycerol
Molecular formula
C48H90O15
Molecular weight
907.22

Names & synonyms

BF-7 diglycosyl diacylglycerolα-D-Mannopyranoside, 3-[(14-methyl-1-oxohexadecyl)oxy]-2-[(14-methyl-1-oxopentadecyl)oxy]propyl 3-O-α-D-glucopyranosyl-

Database identifiers

CAS
156957-28-7
PubChem CID
190861
DTXSID
DTXSID90935574

Properties

Physicochemical properties

Boiling point
940.692 · 940.692±65.00 °C(Press: 760.00 Torr)(predicted)
Density
1.152 · 1.152±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
12.648 · 12.648±0.70(predicted)

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