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CHEBI:139423 - (2S)-3-[(6-O-β-L-glucopyranosyl-β-L-galactopyranosyl)oxy]-2-hydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

ChEBI IDCHEBI:139423
ChEBI Name(2S)-3-[(6-O-β-L-glucopyranosyl-β-L-galactopyranosyl)oxy]-2-hydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
Stars
ASCII Name(2S)-3-[(6-O-beta-L-glucopyranosyl-beta-L-galactopyranosyl)oxy]-2-hydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate
Last Modified15 January 2018
Submittermwilliams
DownloadsMolfile
FormulaC33H56O14
Net Charge0
Average Mass676.797
Monoisotopic Mass676.36701
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@@H](O)CO[C@H]1O[C@@H](CO[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3/b4-3-,7-6-,10-9-/t22-,23+,24+,26+,27-,28-,29-,30+,31+,32+,33+/m1/s1
InChIKeyMPSGDHOYFIUPSO-KEVAINIISA-N
ChEBI Ontology
Outgoing Relation(s)
(2S)-3-[(6-O-β-L-glucopyranosyl-β-L-galactopyranosyl)oxy]-2-hydroxypropyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate (CHEBI:139423) is a glycoglycerolipid (CHEBI:24385)
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