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CHEBI:199338 - 18-O-b-D-Glucopyranosyl-18R-hydroxydihydroalloprotolichesterinate21-O-a-l-rhamnopyranoside

ChEBI IDCHEBI:199338
ChEBI Name18-O-b-D-Glucopyranosyl-18R-hydroxydihydroalloprotolichesterinate21-O-a-l-rhamnopyranoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H58O14
Net Charge0
Average Mass678.813
Monoisotopic Mass678.38266
SMILESC[C@H](CCCCCCCCCCCCC[C@@H]1OC(=O)[C@H](C)[C@@H]1C(=O)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C33H58O14/c1-18(43-32-29(40)27(38)25(36)22(17-34)46-32)15-13-11-9-7-5-4-6-8-10-12-14-16-21-23(19(2)30(41)45-21)31(42)47-33-28(39)26(37)24(35)20(3)44-33/h18-29,32-40H,4-17H2,1-3H3/t18-,19-,20+,21+,22-,23+,24+,25-,26-,27+,28-,29-,32-,33+/m1/s1
InChIKeyDNKGXUZPTUSIQT-JETRDBANSA-N
Species of MetaboliteComponentSourceComments
Acarospora (ncbitaxon:88747) - PubMed (11557085)
ChEBI Ontology
Outgoing Relation(s)
18-O-b-D-Glucopyranosyl-18R-hydroxydihydroalloprotolichesterinate21-O-a-l-rhamnopyranoside (CHEBI:199338) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] (2S,3S,4R)-4-methyl-5-oxo-2-[(14R)-14-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentadecyl]oxolane-3-carboxylate
Manual XrefsDatabases
78439600ChemSpider