CHEBI:222332 - Blazeispirol E

ChEBI IDCHEBI:222332
ChEBI NameBlazeispirol E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34O5
Net Charge0
Average Mass414.542
Monoisotopic Mass414.24062
SMILESCOc1ccc2c(c1CO)C=C[C@]1(C)[C@@H]3CC[C@]21O[C@@]1(OC(C)(C)[C@@H](C)[C@H]1O)[C@H]3C
InChIInChI=1S/C25H34O5/c1-14-18-10-12-24(30-25(14)21(27)15(2)22(3,4)29-25)19-7-8-20(28-6)17(13-26)16(19)9-11-23(18,24)5/h7-9,11,14-15,18,21,26-27H,10,12-13H2,1-6H3/t14-,15-,18+,21+,23+,24-,25-/m0/s1
InChIKeyZZLUANSADFHKRE-OFDNLDAYSA-N
Species of MetaboliteComponentSourceComments
Agaricus blazei (ncbitaxon:79798) - DOI (10.1016/s0031-9422(01)00445-9)
ChEBI Ontology
Outgoing Relation(s)
Blazeispirol E (CHEBI:222332) is a organic heterotricyclic compound (CHEBI:26979)
Blazeispirol E (CHEBI:222332) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1R,3'R,4'S,10R,11R,12S,13S)-6-(hydroxymethyl)-5-methoxy-4',5',5',10,12-pentamethylspiro[14-oxatetracyclo[9.3.2.01,10.02,7]hexadeca-2(7),3,5,8-tetraene-13,2'-oxolane]-3'-ol
Manual XrefsDatabases
78437698ChemSpider