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CHEBI:226318 - Ganoleucin D

ChEBI IDCHEBI:226318
ChEBI NameGanoleucin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H30O11
Net Charge0
Average Mass590.581
Monoisotopic Mass590.17881
SMILESC=C(COC(=O)[C@@H]1CC[C@@H](C(=C)CO)[C@@]12Oc1ccc(O)cc1C2=O)[C@@H]1CC[C@@H](C(=O)O)[C@]12Oc1ccc(O)cc1C2=O
InChIInChI=1S/C32H30O11/c1-15(13-33)21-6-8-24(32(21)28(37)20-12-18(35)4-10-26(20)43-32)30(40)41-14-16(2)22-5-7-23(29(38)39)31(22)27(36)19-11-17(34)3-9-25(19)42-31/h3-4,9-12,21-24,33-35H,1-2,5-8,13-14H2,(H,38,39)/t21-,22-,23-,24-,31+,32+/m0/s1
InChIKeyDGLHQRMXGDBMDN-MWHADTDPSA-N
Species of MetaboliteComponentSourceComments
Ganoderma leucocontextum (ncbitaxon:1566825) - PubMed (28536459)
ChEBI Ontology
Outgoing Relation(s)
Ganoleucin D (CHEBI:226318) is a benzofurans (CHEBI:35259)
IUPAC Name 
(1'R,2R,3'S)-5-hydroxy-3'-[3-[(1'R,2R,3'S)-5-hydroxy-3'-(3-hydroxyprop-1-en-2-yl)-3-oxospiro[1-benzouran-2,2'-cyclopentane]-1'-carbonyl]oxyprop-1-en-2-yl]-3-oxospiro[1-benzouran-2,2'-cyclopentane]-1'-carboxylic acid
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