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CHEBI:202736 - 15-hydroxy-16-alpha-D-mannopyranosyloxyisopimar-7-en-19-oic acid

ChEBI IDCHEBI:202736
ChEBI Name15-hydroxy-16-alpha-D-mannopyranosyloxyisopimar-7-en-19-oic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H42O9
Net Charge0
Average Mass498.613
Monoisotopic Mass498.28288
SMILESC[C@]1(C(O)CO[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)CC[C@H]2C(=CC[C@@H]3[C@]2(C)CCC[C@]3(C)C(=O)O)C1
InChIInChI=1S/C26H42O9/c1-24(18(28)13-34-22-21(31)20(30)19(29)16(12-27)35-22)10-7-15-14(11-24)5-6-17-25(15,2)8-4-9-26(17,3)23(32)33/h5,15-22,27-31H,4,6-13H2,1-3H3,(H,32,33)/t15-,16+,17+,18?,19+,20-,21-,22-,24-,25+,26-/m0/s1
InChIKeyKXBJSCLFLJEGIJ-MRVGKFLGSA-N
Species of MetaboliteComponentSourceComments
Xylaria polymorpha (ncbitaxon:77046) - PubMed (19467682)
ChEBI Ontology
Outgoing Relation(s)
15-hydroxy-16-alpha-D-mannopyranosyloxyisopimar-7-en-19-oic acid (CHEBI:202736) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
(1S,4aR,4bS,7S,10aR)-7-[1-hydroxy-2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Manual XrefsDatabases
78440905ChemSpider