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CHEBI:202474 - Spirodihydrobenzofuranlactam IV

ChEBI IDCHEBI:202474
ChEBI NameSpirodihydrobenzofuranlactam IV
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H37NO8
Net Charge0
Average Mass515.603
Monoisotopic Mass515.25192
SMILESCC1CCC2C(C)(C)C(O)CCC2(C)C12Cc1c(cc3c(c1O)CN(C(CCC(=O)O)C(=O)O)C3=O)O2
InChIInChI=1S/C28H37NO8/c1-14-5-7-20-26(2,3)21(30)9-10-27(20,4)28(14)12-16-19(37-28)11-15-17(23(16)33)13-29(24(15)34)18(25(35)36)6-8-22(31)32/h11,14,18,20-21,30,33H,5-10,12-13H2,1-4H3,(H,31,32)(H,35,36)
InChIKeyXSIHIBRCLUCPAO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Stachybotrysspecies (ncbitaxon:1718872) - PubMed (8642001)
ChEBI Ontology
Outgoing Relation(s)
Spirodihydrobenzofuranlactam IV (CHEBI:202474) is a glutamic acid derivative (CHEBI:24315)
IUPAC Name 
2-(3,4'-dihydroxy-4,4,7,8a-tetramethyl-7'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,5-dihydrouro[2,3-]isoindole]-6'-yl)pentanedioic acid
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