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CHEBI:235373 - 17-[(6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucosyl)oxy]-oleate-6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucoside

ChEBI IDCHEBI:235373
ChEBI Name17-[(6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucosyl)oxy]-oleate-6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucoside
Stars
ASCII Name17-[(6-O-acetyl-beta-D-glucosyl-(1->2)-6-O-acetyl-beta-D-glucosyl)oxy]-oleate-6-O-acetyl-beta-D-glucosyl-(1->2)-6-O-acetyl-beta-D-glucoside
Submitterlaimo
DownloadsMolfile
FormulaC50H82O27
Net Charge0
Average Mass1115.179
Monoisotopic Mass1114.50435
SMILESCC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(C)CCCCCC/C=C\CCCCCCCC(=O)O[C@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@H](COC(C)=O)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](COC(C)=O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C50H82O27/c1-25(70-49-45(41(62)37(58)32(73-49)23-68-28(4)53)76-47-43(64)39(60)35(56)30(71-47)21-66-26(2)51)19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-34(55)75-50-46(42(63)38(59)33(74-50)24-69-29(5)54)77-48-44(65)40(61)36(57)31(72-48)22-67-27(3)52/h6-7,25,30-33,35-50,56-65H,8-24H2,1-5H3/b7-6-/t25?,30-,31-,32-,33-,35-,36-,37-,38-,39+,40+,41+,42+,43-,44-,45-,46-,47+,48+,49-,50-/m1/s1
InChIKeyXHCWWGGCMHXKCH-IMJVEFGTSA-N
Species of MetaboliteComponentSourceComments
Starmerella bombicola- PubMed (38937850)
ChEBI Ontology
Outgoing Relation(s)
17-[(6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucosyl)oxy]-oleate-6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucoside (CHEBI:235373) is a sophorolipid (CHEBI:51075)
Synonyms  Source
tetraAc bolaform sophorolipid (C18:1(9Z), ω-1-OH)SUBMITTER
17-hydroxyoleate tetra-acetylated disophorosideSUBMITTER
UniProt Name  Source
(9Z)-17-[(6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucosyl)oxy]-octadecenoate-6-O-acetyl-β-D-glucosyl-(1→2)-6-O-acetyl-β-D-glucosideUniProt