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CHEBI:223802 - 24-alpha-D-glucosyl-(-)-terpestacin

ChEBI IDCHEBI:223802
ChEBI Name24-alpha-D-glucosyl-(-)-terpestacin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H48O9
Net Charge0
Average Mass564.716
Monoisotopic Mass564.32983
SMILESC/C1=C/CC/C(C)=C/C[C@]2(C)C(=O)C(O)=C([C@H](C)CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]2C/C=C(\C)[C@@H](O)CC1
InChIInChI=1S/C31H48O9/c1-17-7-6-8-18(2)13-14-31(5)21(11-10-19(3)22(33)12-9-17)24(26(35)29(31)38)20(4)16-39-30-28(37)27(36)25(34)23(15-32)40-30/h7,10,13,20-23,25,27-28,30,32-37H,6,8-9,11-12,14-16H2,1-5H3/b17-7-,18-13+,19-10+/t20-,21-,22+,23-,25-,27+,28-,30+,31+/m1/s1
InChIKeyRVSWMQVCYJCHMC-DAUADZTISA-N
Species of MetaboliteComponentSourceComments
Alternaria alternata (ncbitaxon:5599) - DOI (10.1016/j.phytol.2015.10.024)
ChEBI Ontology
Outgoing Relation(s)
24-alpha-D-glucosyl-(-)-terpestacin (CHEBI:223802) is a glycoside (CHEBI:24400)
IUPAC Name 
(1R,3E,5S,8Z,12E,15S)-5,17-dihydroxy-4,8,12,15-tetramethyl-18-[(2S)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]bicyclo[13.3.0]octadeca-3,8,12,17-tetraen-16-one
Manual XrefsDatabases
78443423ChemSpider