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CHEBI:208645 - Hansforester C

ChEBI IDCHEBI:208645
ChEBI NameHansforester C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H44O17
Net Charge0
Average Mass796.775
Monoisotopic Mass796.25785
SMILESC/C=C/C(=O)Cc1cc(O)cc(O)c1C(=O)O[C@H](C)CC(=O)O[C@H](C)Cc1cc(O)cc(O)c1C(=O)O[C@H](C)CC(=O)O[C@H](C)Cc1cc(O)cc(O)c1C(=O)O
InChIInChI=1S/C40H44O17/c1-6-7-26(41)12-25-15-29(44)18-32(47)37(25)40(53)57-22(5)11-34(49)55-20(3)9-24-14-28(43)17-31(46)36(24)39(52)56-21(4)10-33(48)54-19(2)8-23-13-27(42)16-30(45)35(23)38(50)51/h6-7,13-22,42-47H,8-12H2,1-5H3,(H,50,51)/b7-6+/t19-,20-,21-,22-/m1/s1
InChIKeyGSFSQDGNNVDWOU-KQWMUXCGSA-N
Species of MetaboliteComponentSourceComments
Ascotricha sinuosa (ncbitaxon:1217297) - DOI (10.1039/c8ra08606k)
ChEBI Ontology
Outgoing Relation(s)
Hansforester C (CHEBI:208645) has functional parent hexacarboxylic acid (CHEBI:59359)
Hansforester C (CHEBI:208645) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
2-[(2R)-2-[(3R)-3-[2-[(2R)-2-[(3R)-3-[2,4-dihydroxy-6-[(E)-2-oxopent-3-enyl]benzoyl]oxybutanoyl]oxypropyl]-4,6-dihydroxybenzoyl]oxybutanoyl]oxypropyl]-4,6-dihydroxybenzoic acid
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