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25637-85-8

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Basic Information
CAS No.: 25637-85-8
Name: Sucrose dioleate
Molecular Structure:
Molecular Structure of 25637-85-8 (Sucrose dioleate)
Formula: C48H86O13
Molecular Weight: 871.1886
Synonyms: Sucrose dioleate; [(2S,3S,4R,5R)-2-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(Z)-octadec-9-enoyl]oxy-tetrahydropyran-2-yl]oxy-4-hydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-3-yl] (Z)-octadec-9-enoate
EINECS: 247-145-8
Density: 1.13g/cm3
Boiling Point: 897.7°C at 760 mmHg
Flash Point: 245.6°C
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Specification

The CAS registry number of Sucrose dioleate is 25637-85-8. This chemical's molecular formula is C48H86O13 and molecular weight is 871.1886. What's more, its systematic name is [(2S,3S,4R,5R)-2-[(2R,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(Z)-octadec-9-enoyl]oxy-tetrahydropyran-2-yl]oxy-4-hydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-3-yl] (Z)-octadec-9-enoate.

You can still convert the following datas into molecular structure:
(1) SMILES: CCCCCCCC\C=C/CCCCCCCC(=O)O[C@H]1[C@H](O[C@H](CO)[C@@H](O)[C@@H]1O)O[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2OC(=O)CCCCCCC/C=C\CCCCCCCC
(2) InChI: InChI=1/C48H86O13/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(52)58-45-44(56)42(54)38(35-49)57-47(45)61-48(37-51)46(43(55)39(36-50)60-48)59-41(53)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,38-39,42-47,49-51,54-56H,3-16,21-37H2,1-2H3/b19-17-,20-18-/t38-,39-,42-,43-,44+,45-,46+,47-,48+/m1/s1
(3) InChIKey: XPTKHJYCRZUHJY-FSAWCSQFBR