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CHEBI:227057 - (2R,3R,2'S)-2-Hydroxymyxol 2'-fucoside

ChEBI IDCHEBI:227057
ChEBI Name(2R,3R,2'S)-2-Hydroxymyxol 2'-fucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H66O8
Net Charge0
Average Mass747.026
Monoisotopic Mass746.47577
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C/[C@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)C(C)(C)O)C(C)(C)[C@@H](O)[C@H](O)C1
InChIInChI=1S/C46H66O8/c1-30(17-12-13-18-31(2)20-15-23-33(4)25-27-37-35(6)29-38(47)43(51)45(37,8)9)19-14-21-32(3)22-16-24-34(5)26-28-39(46(10,11)52)54-44-42(50)41(49)40(48)36(7)53-44/h12-28,36,38-44,47-52H,29H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,28-26+,30-17+,31-18+,32-21+,33-23+,34-24+/t36-,38+,39-,40+,41+,42-,43-,44-/m0/s1
InChIKeyZMWZXRUZZKSPPM-LZKPMYRZSA-N
Species of MetaboliteComponentSourceComments
Thermosynechococcus (ncbitaxon:146785) - PubMed (18794175)
ChEBI Ontology
Outgoing Relation(s)
(2R,3R,2'S)-2-Hydroxymyxol 2'-fucoside (CHEBI:227057) is a xanthophyll (CHEBI:27325)
IUPAC Name 
(2S,3S,4R,5S,6S)-2-[(3S,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-25-[(4R,5R)-4,5-dihydroxy-2,6,6-trimethylcyclohexen-1-yl]-2-hydroxy-2,6,10,14,19,23-hexamethylpentacosa-4,6,8,10,12,14,16,18,20,22,24-undecaen-3-yl]oxy-6-methyloxane-3,4,5-triol
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