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CHEBI:213707 - Hyalodendroside B

ChEBI IDCHEBI:213707
ChEBI NameHyalodendroside B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC38H60O10
Net Charge0
Average Mass676.888
Monoisotopic Mass676.41865
SMILESCC(=O)O[C@@H]1C[C@]2(CO)[C@H]3CCC4=C5C(=O)CC(C(C)C)C5(C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C(C)(C)[C@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C38H60O10/c1-19(2)22-15-23(42)28-21-9-10-27-37(8,36(21,7)14-13-35(22,28)6)12-11-26-34(4,5)32(24(46-20(3)41)16-38(26,27)18-40)48-33-31(45)30(44)29(43)25(17-39)47-33/h19,22,24-27,29-33,39-40,43-45H,9-18H2,1-8H3/t22?,24-,25-,26+,27+,29-,30+,31-,32+,33+,35?,36-,37-,38-/m1/s1
InChIKeyCXHPXRHMWVTPLG-KGYFCOBJSA-N
Species of MetaboliteComponentSourceComments
Hyalodendron (ncbitaxon:157613) - PubMed (10650085)
ChEBI Ontology
Outgoing Relation(s)
Hyalodendroside B (CHEBI:213707) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
[(5aS,5bR,7aR,9R,10R,11aS,11bS)-11a-(hydroxymethyl)-3a,5a,5b,8,8-pentamethyl-1-oxo-3-propan-2-yl-9-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6,7,7a,9,10,11,11b,12,13-dodecahydro-2H-cyclopenta[a]chrysen-10-yl] acetate
Manual XrefsDatabases
10269601ChemSpider