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CHEBI:213132 - Duotap-520

Default Structure
ChEBI IDCHEBI:213132
ChEBI NameDuotap-520
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H32O5
Net Charge0
Average Mass520.625
Monoisotopic Mass520.22497
SMILESCC(C)C1=C(O)C(c2c(/C=C/c3ccccc3)cc(O)c(C(C)C)c2O)=C(/C=C/c2ccccc2)C(=O)C1=O
InChIInChI=1S/C34H32O5/c1-20(2)27-26(35)19-24(17-15-22-11-7-5-8-12-22)29(32(27)37)30-25(18-16-23-13-9-6-10-14-23)31(36)34(39)28(21(3)4)33(30)38/h5-21,35,37-38H,1-4H3/b17-15+,18-16+
InChIKeyMTFRIWPSAYYZIN-YTEMWHBBSA-N
Species of MetaboliteComponentSourceComments
Photorhabdus luminescens (ncbitaxon:29488) - PubMed (32097515)
ChEBI Ontology
Outgoing Relation(s)
Duotap-520 (CHEBI:213132) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
4-[2,4-dihydroxy-6-[(E)-2-phenylethenyl]-3-propan-2-ylphenyl]-5-hydroxy-3-[(E)-2-phenylethenyl]-6-propan-2-ylcyclohexa-3,5-diene-1,2-dione