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CHEBI:210583 - Dasyscyphin C

ChEBI IDCHEBI:210583
ChEBI NameDasyscyphin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H40O8
Net Charge0
Average Mass504.620
Monoisotopic Mass504.27232
SMILESCC(O)(CC(=O)O)CC(=O)OCC1=C[C@@]2(O)[C@H](C[C@@H]3[C@@]4(C)CCCC(C)(C)[C@@H]4CC[C@@]32C)C(=O)C1=O
InChIInChI=1S/C28H40O8/c1-24(2)8-6-9-26(4)18(24)7-10-27(5)19(26)11-17-23(33)22(32)16(12-28(17,27)35)15-36-21(31)14-25(3,34)13-20(29)30/h12,17-19,34-35H,6-11,13-15H2,1-5H3,(H,29,30)/t17-,18+,19-,25?,26+,27+,28-/m1/s1
InChIKeyVBYFVFMZJVTSHX-YHKOIMIKSA-N
Species of MetaboliteComponentSourceComments
Dasyscyphus (ncbitaxon:318839) - DOI (10.1016/j.tet.2005.11.041)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dasyscyphin C (CHEBI:210583) is a hydroxy fatty acid (CHEBI:24654)
IUPAC Name 
5-[[(4aS,6aS,6bR,10aS,11aR,11bS)-6b-hydroxy-4,4,6a,11b-tetramethyl-9,10-dioxo-2,3,4a,5,6,10a,11,11a-octahydro-1H-benzo[a]luoren-8-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
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