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CHEBI:207026 - Gartryprostatin B

ChEBI IDCHEBI:207026
ChEBI NameGartryprostatin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H31N3O6
Net Charge0
Average Mass481.549
Monoisotopic Mass481.22129
SMILESCC1(C)C=Cc2c(ccc3c2N[C@@]24N5C(=O)[C@]6(O)CCCN6C(=O)[C@@H]5C[C@@]32O[C@H](CO)C4(C)C)O1
InChIInChI=1S/C26H31N3O6/c1-22(2)10-8-14-17(34-22)7-6-15-19(14)27-26-23(3,4)18(13-30)35-24(15,26)12-16-20(31)28-11-5-9-25(28,33)21(32)29(16)26/h6-8,10,16,18,27,30,33H,5,9,11-13H2,1-4H3/t16-,18+,24+,25+,26-/m0/s1
InChIKeyNWGFWOCPCGSAFK-NKSHKIKBSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31479263)
ChEBI Ontology
Outgoing Relation(s)
Gartryprostatin B (CHEBI:207026) is a pyrroloindole (CHEBI:48133)
IUPAC Name 
(1R,13S,16R,22S,25S)-16-hydroxy-25-(hydroxymethyl)-7,7,26,26-tetramethyl-6,24-dioxa-12,14,20-triazaheptacyclo[11.10.3.01,13.02,11.05,10.014,22.016,20]hexacosa-2(11),3,5(10),8-tetraene-15,21-dione