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Substance Name: 7-Ketocholesteryl-3-oleate
RN: 145889-56-1
InChIKey: ISBJKIMEDSBZAJ-WIIUZAFWSA-N

Molecular Weight

  • 665.092
 
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Names and Synonyms

  • 7-Ketocholesteryl-3-oleate

Registry Numbers

CAS Registry Number

  • 145889-56-1

System Generated Number

  • 0145889561

Structure Descriptors

InChI

1S/C45H76O3/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-42(47)48-37-28-30-44(5)36(32-37)33-41(46)43-39-27-26-38(35(4)24-22-23-34(2)3)45(39,6)31-29-40(43)44/h14-15,33-35,37-40,43H,7-13,16-32H2,1-6H3/b15-14+/t35-,37+,38-,39+,40+,43+,44+,45-/m1/s1

InChIKey

ISBJKIMEDSBZAJ-WIIUZAFWSA-N

Smiles

C1[C@@H](CC2=CC([C@H]3[C@@H]4CC[C@@H]([C@@H](CCCC(C)C)C)[C@@]4(C)CC[C@H]3[C@@]2(C1)C)=O)OC(CCCCCCC\C=C\CCCCCCCC)=O