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CHEBI:217465 - Stelliosphaerol B

ChEBI IDCHEBI:217465
ChEBI NameStelliosphaerol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H38O6
Net Charge0
Average Mass386.529
Monoisotopic Mass386.26684
SMILESCC1=CCC[C@@H](C)[C@]1(C)CC/C(C)=C/CO[C@@H]([C@H](O)[C@H](O)CO)[C@H](O)CO
WURCSWURCS=2.0/1,1,0/[h1122h_3*OCC=^ECCCC^SC=^XCCCC^R$8/13C/9C/8C/5C]/1/
InChIInChI=1S/C21H38O6/c1-14(8-10-21(4)15(2)6-5-7-16(21)3)9-11-27-20(18(25)13-23)19(26)17(24)12-22/h6,9,16-20,22-26H,5,7-8,10-13H2,1-4H3/b14-9+/t16-,17-,18-,19-,20-,21-/m1/s1
InChIKeyNUQRDCRYPQGHIN-IXQNCCIPSA-N
ChEBI Ontology
Outgoing Relation(s)
Stelliosphaerol B (CHEBI:217465) is a hexose (CHEBI:18133)
IUPAC Name 
(2R,3R,4R,5R)-4-[(E)-3-methyl-5-[(1S,6R)-1,2,6-trimethylcyclohex-2-en-1-yl]pent-2-enoxy]hexane-1,2,3,5,6-pentol
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